naphthaleno[3](2,6)pyridinophane, 19-(dimethylamino-](/api/spectrum/gemNOxN8P1/structure.png?h=300&w=458 "2,13-Dithia[3](1,4)naphthaleno[3](2,6)pyridinophane, 19-(dimethylamino-")
| SpectraBase Compound ID | tkdawUXym1 |
|---|---|
| InChI | InChI=1S/C21H23BrN2S2/c1-23(2)17-9-18-13-25-11-15-7-8-16(21-6-4-3-5-20(15)21)12-26-14-19(10-17)24(18)22/h3-10,24H,11-14H2,1-2H3 |
| InChIKey | ANWWIVXPRBCVED-UHFFFAOYSA-N |
| Mol Weight | 447.45 g/mol |
| Molecular Formula | C21H23BrN2S2 |
| Exact Mass | 446.048604 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | gemNOxN8P1 |
|---|---|
| Name | 2,13-Dithia[3](1,4)naphthaleno[3](2,6)pyridinophane, 19-(dimethylamino- |
| Alternate Name(s) | 2,13-Dithia[3](1,4)naphthalino[3](2,6)pyridinophan, 19-(dimethylamino- 22-bromo-N,N-dimethyl-3,11-dithia-22lambda(5)-azatetracyclo[11.6.2.1(5,9).0(14,19)]docosa-1(19),5(22),6,8,13,15,17,20-octaen-7-amine N-[22-bromo-3,11-dithia-22lambda(5)-azatetracyclo[11.6.2.1(5,9).0(14,19)]docosa-1(19),5(22),6,8,13,15,17,20-octaen-7-yl]-N,N-dimethylamine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H23BrN2S2 |
| InChI | InChI=1S/C21H23BrN2S2/c1-23(2)17-9-18-13-25-11-15-7-8-16(21-6-4-3-5-20(15)21)12-26-14-19(10-17)24(18)22/h3-10,24H,11-14H2,1-2H3 |
| InChIKey | ANWWIVXPRBCVED-UHFFFAOYSA-N |
| Molecular Weight | 447.453 g/mol |
| SMILES | C1c2cc(cc(n2Br)CSCc2c3c(c(CS1)cc2)cccc3)N(C)C |
| SPLASH | splash10-00lr-1903000000-d5749313b5d2281d4ae8 |
| Wiley ID | 1493684 |