Vitas-M small molecule compound
1-chloro-2-[(2-nitrophenyl)sulfanyl]-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid
Catalog ID
STK523154
SMILES ClC1C(CC2C1c1cc(ccc1NC2c1ccccc1)C(=O)O)Sc1ccccc1[N+](=O)[O-]
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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 C25H21ClN2O4S MW 480.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O4S/c26-23-21(33-20-9-5-4-8-19(20)28(31)32)13-17-22(23)16-12-15(25(29)30)10-11-18(16)27-24(17)14-6-2-1-3-7-14/h1-12,17,21-24,27H,13H2,(H,29,30)InChIKey
GEQGUCRYYIPLPX-UHFFFAOYSA-NSynonyms
1chloro2((2nitrophenyl)sulfanyl)4phenyl233a459bhexahydro1Hcyclopenta(c)quinoline8carboxylicacid
1CHLORO2(2NITROPHENYL)SULFANYL4PHENYL233A459BHEXAHYDRO1HCYCLOPENTA(C)QUINOLINE8CARBOXYLICACID
C1C2C(C(C1SC3=CC=CC=C3(N+)(=O)(O))Cl)C4=C(C=CC(=C4)C(=O)O)NC2C5=CC=CC=C5
ClC1C(CC2C1c1cc(ccc1NC2c1ccccc1)C(=O)O)Sc1ccccc1(N+)(=O)(O)
InChI=1SC25H21ClN2O4Sc262321(3320954819(20)28(31)32)131722(23)161215(25(29)30)101118(16)2724(17)146213714h11217212427H13H2(H2930)
MFCD01117073
ZINC000101138122
ZINC000229971458
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