| SpectraBase Spectrum ID |
EzZeFOXrM1M |
| Name |
#3D;2,3,6,7-TETRAHYDRO-4-(4-METHOXYPHENYL)-3-(3-METHOXYPHENYL-3-OXO-1-PHENYLPROPYL)-7-METHYL-8-METHYLTHIO-2-PHENYL-1H-PYRIMIDO-[4.5-B]-[1.4]-DIAZEPIN-6-ONE |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C38H36N4O4S |
| InChI |
InChI=1S/C38H36N4O4S/c1-42-37(44)35-36(41-38(42)47-4)40-34(26-13-9-6-10-14-26)32(33(39-35)27-17-21-29(46-3)22-18-27)30(24-11-7-5-8-12-24)23-31(43)25-15-19-28(45-2)20-16-25/h5-22,30,32,34,40H,23H2,1-4H3/t30-,32-,34+/m1/s1 |
| InChIKey |
KECRSOSOCIOLJU-PXTZSQHASA-N |
| Literature Reference Author |
B.INSUASTY,M.RAMOS,R.MORENO,J.QUIROGA,A.SANCHEZ,M.NOGUERAS,N
.HANOLD,H.MEIER |
| Literature Reference Citation |
J.HETCYCL.CHEM.,32,1229(1995) |
| Literature Reference DOI |
10.1002/jhet.5570320423 |
| Molecular Weight |
644.788 g/mol |
| Solvent |
DMSO-D6 |
| Source File Reference |
UWMK374 |
![#3D;2,3,6,7-TETRAHYDRO-4-(4-METHOXYPHENYL)-3-(3-METHOXYPHENYL-3-OXO-1-PHENYLPROPYL)-7-METHYL-8-METHYLTHIO-2-PHENYL-1H-PYRIMIDO-[4.5-B]-[1.4]-DIAZEPIN-6-ONE](/api/spectrum/EzZeFOXrM1M/structure.png?h=300&w=458 "#3D;2,3,6,7-TETRAHYDRO-4-(4-METHOXYPHENYL)-3-(3-METHOXYPHENYL-3-OXO-1-PHENYLPROPYL)-7-METHYL-8-METHYLTHIO-2-PHENYL-1H-PYRIMIDO-[4.5-B]-[1.4]-DIAZEPIN-6-ONE")
