Vitas-M small molecule compound
1-chloro-4-(4-fluorophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid
Catalog ID
STK523148
SMILES Fc1ccc(cc1)C1Nc2ccc(cc2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])C(=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 C25H20ClFN2O4S MW 498.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClFN2O4S/c26-23-21(34-20-4-2-1-3-19(20)29(32)33)12-17-22(23)16-11-14(25(30)31)7-10-18(16)28-24(17)13-5-8-15(27)9-6-13/h1-11,17,21-24,28H,12H2,(H,30,31)InChIKey
SIPUAVBPFFADQX-UHFFFAOYSA-NSynonyms
1chloro4(4fluorophenyl)2((2nitrophenyl)sulfanyl)233a459bhexahydro1Hcyclopenta(c)quinoline8carboxylicacid
1CHLORO4(4FLUOROPHENYL)2(2NITROPHENYL)SULFANYL233A459BHEXAHYDRO1HCYCLOPENTA(C)QUINOLINE8CARBOXYLICACID
C1C2C(C(C1SC3=CC=CC=C3(N+)(=O)(O))Cl)C4=C(C=CC(=C4)C(=O)O)NC2C5=CC=C(C=C5)F
Fc1ccc(cc1)C1Nc2ccc(cc2C2C1CC(C2Cl)Sc1ccccc1(N+)(=O)(O))C(=O)O
InChI=1SC25H20ClFN2O4Sc262321(3420421319(20)29(32)33)121722(23)161114(25(30)31)71018(16)2824(17)135815(27)9613h11117212428H12H2(H3031)
MFCD01117076
ZINC000012375673
ZINC000229976387
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