![1,3-bis(4"-Chlorophenyl)-2,4-bis[(3'-methylthio-6'-methyl-5'-oxo-1',2',4'-triazin-4'-yl)imino]-1,3-diazetidine](/api/spectrum/DTUn5iBi6L6/structure.png?h=300&w=458 "1,3-bis(4\"-Chlorophenyl)-2,4-bis[(3'-methylthio-6'-methyl-5'-oxo-1',2',4'-triazin-4'-yl)imino]-1,3-diazetidine")
| SpectraBase Compound ID | AsMVaRRA3X2 |
|---|---|
| InChI | InChI=1S/C24H20Cl2N10O2S2/c1-13-19(37)35(23(39-3)29-27-13)31-21-33(17-9-5-15(25)6-10-17)22(34(21)18-11-7-16(26)8-12-18)32-36-20(38)14(2)28-30-24(36)40-4/h5-12H,1-4H3/b31-21-,32-22- |
| InChIKey | SCOZHEQAXNZQNK-RYJWMXFHSA-N |
| Mol Weight | 615.52 g/mol |
| Molecular Formula | C24H20Cl2N10O2S2 |
| Exact Mass | 614.058918 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DTUn5iBi6L6 |
|---|---|
| Name | 1,3-bis(4"-Chlorophenyl)-2,4-bis[(3'-methylthio-6'-methyl-5'-oxo-1',2',4'-triazin-4'-yl)imino]-1,3-diazetidine |
| Alternate Name(s) | 1,2,4-Triazin-5(4H)-one, 4,4'-[[1,3-bis(4-chlorophenyl)-1,3-diazetidine-2,4-diylidene]dinitrilo]bis[6-methyl-3-(methylthio)-, (Z)- 1,3-bis-(4-chlorophenyl)-2,4-bis(6-methyl-2-methylthio-5-oxo-4,5-dihydro-1,2,4-triazin-4-ylimino)-1,3-diazetidine 1,3-bis(4''-Chlorophenyl)-2,4-bis[(3'-thiomethyl-6'-methyl-5'-oxo-1',2',4'-triazin-4'-yl)imino]-1,3-diazetidine 1,3-Diazetidine, 1,2,4-triazin-5(4H)-one deriv. 1,3-bis(4''-Chlorophenyl)-2,4-bis[(3'-methylthio-6'-methyl-5'-oxo-1',2',4'-triazin-4'-yl)imino]-1,3-diazetidine 1,3-bis(4''-Chlorophenyl)-2,4-bis[(3'-thiomethyl-6'-methyl-5'-oxo-1',2',4'-triazin-4'-yl)imino]-1,3-diazetidine 4-({1,3-bis(4-chlorophenyl)-4-[(6-methyl-3-(methylsulfanyl)-5-oxo-1,2,4-triazin-4(5H)-yl)imino]-1,3-diazetidin-2-ylidene}amino)-6-methyl-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one |
| CAS Registry Number | 109106-96-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H20Cl2N10O2S2 |
| InChI | InChI=1S/C24H20Cl2N10O2S2/c1-13-19(37)35(23(39-3)29-27-13)31-21-33(17-9-5-15(25)6-10-17)22(34(21)18-11-7-16(26)8-12-18)32-36-20(38)14(2)28-30-24(36)40-4/h5-12H,1-4H3/b31-21-,32-22- |
| InChIKey | SCOZHEQAXNZQNK-RYJWMXFHSA-N |
| Molecular Weight | 615.518 g/mol |
| SMILES | c1(N2\C(N(\C2=N\N2C(C(C)=NN=C2SC)=O)c2ccc(cc2)Cl)=N\N2C(C(C)=NN=C2SC)=O)ccc(cc1)Cl |
| SPLASH | splash10-0gb9-3912000000-b036f8561c593ea6107d |
| Source of Spectrum | KC-1986-2046-21 |
| Wiley ID | 1411158 |