Vitas-M small molecule compound
4-[(3aS,4R,9bR)-8-(naphthalen-1-ylsulfamoyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoic acid
Catalog ID
STK327965
SMILES OC(=O)c1ccc(cc1)[C@@H]1Nc2ccc(cc2[C@H]2[C@@H]1CC=C2)S(=O)(=O)Nc1cccc2c1cccc2
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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 C29H24N2O4S MW 496.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O4S/c32-29(33)20-13-11-19(12-14-20)28-24-9-4-8-23(24)25-17-21(15-16-26(25)30-28)36(34,35)31-27-10-3-6-18-5-1-2-7-22(18)27/h1-8,10-17,23-24,28,30-31H,9H2,(H,32,33)/t23-,24+,28+/m1/s1InChIKey
CTPFNZRVWWGLTP-NYULUDCUSA-NSynonyms
4((3AS4R9BR)8(NAPHTHALEN1YLSULFAMOYL)3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLIN4YL)BENZOICACID
C1C=CC2C1C(NC3=C2C=C(C=C3)S(=O)(=O)NC4=CC=CC5=CC=CC=C54)C6=CC=C(C=C6)C(=O)O
InChI=1SC29H24N2O4Sc3229(33)20131119(121420)282494823(24)251721(151626(25)3028)36(3435)3127103618512722(18)27h1810172324283031H9H2(H3233)t2324+28+m1s1
MFCD13368607
OC(=O)c1ccc(cc1)(C@@H)1Nc2ccc(cc2(C@H)2(C@@H)1CC=C2)S(=O)(=O)Nc1cccc2c1cccc2
ZINC000018190829
ZINC18190829
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