Vitas-M small molecule compound
1-chloro-4-(4-nitrophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,11c-hexahydro-1H-benzo[f]cyclopenta[c]quinoline
Catalog ID
STK374968
SMILES [O-][N+](=O)c1ccc(cc1)C1Nc2ccc3c(c2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])cccc3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H22ClN3O4S MW 532.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN3O4S/c29-27-24(37-23-8-4-3-7-22(23)32(35)36)15-20-26(27)25-19-6-2-1-5-16(19)11-14-21(25)30-28(20)17-9-12-18(13-10-17)31(33)34/h1-14,20,24,26-28,30H,15H2InChIKey
GUTBZWPDHFRXQM-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)C1Nc2ccc3c(c2C2C1CC(C2Cl)Sc1ccccc1(N+)(=O)(O))cccc3
1chloro4(4nitrophenyl)2((2nitrophenyl)sulfanyl)233a4511chexahydro1Hbenzo(f)cyclopenta(c)quinoline
C1C2C(C(C1SC3=CC=CC=C3(N+)(=O)(O))Cl)C4=C(C=CC5=CC=CC=C54)NC2C6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC28H22ClN3O4Sc292724(3723843722(23)32(35)36)152026(27)2519621516(19)111421(25)3028(20)1791218(131017)31(33)34h1142024262830H15H2
MFCD01117081
ZINC000239073263
ZINC000239073266
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