Vitas-M small molecule compound
1-chloro-2-[(2-nitrophenyl)sulfanyl]-4-phenyl-2,3,3a,4,5,11c-hexahydro-1H-benzo[f]cyclopenta[c]quinoline
Catalog ID
STK701373
SMILES [O-][N+](=O)c1ccccc1SC1CC2C(C1Cl)c1c(NC2c2ccccc2)ccc2c1cccc2
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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 C28H23ClN2O2S MW 487.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN2O2S/c29-27-24(34-23-13-7-6-12-22(23)31(32)33)16-20-26(27)25-19-11-5-4-8-17(19)14-15-21(25)30-28(20)18-9-2-1-3-10-18/h1-15,20,24,26-28,30H,16H2InChIKey
MNJHTWREHWCETR-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccccc1SC1CC2C(C1Cl)c1c(NC2c2ccccc2)ccc2c1cccc2
1chloro2((2nitrophenyl)sulfanyl)4phenyl233a4511chexahydro1Hbenzo(f)cyclopenta(c)quinoline
1chloro2((2nitrophenyl)thio)4phenyl233a4511chexahydro1Hbenzo(f)cyclopenta(c)quinoline
C1C2C(C(C1SC3=CC=CC=C3(N+)(=O)(O))Cl)C4=C(C=CC5=CC=CC=C54)NC2C6=CC=CC=C6
InChI=1SC28H23ClN2O2Sc292724(342313761222(23)31(32)33)162026(27)25191154817(19)141521(25)3028(20)1892131018h1152024262830H16H2
MFCD01133943
ZINC000239347242
ZINC000239347245
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