Vitas-M small molecule compound
4-({[(3aS,4R,9bR)-4-(4-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]sulfonyl}amino)benzoic acid
Catalog ID
STL222026
SMILES Clc1ccc(cc1)[C@@H]1Nc2ccc(cc2[C@H]2[C@@H]1CC=C2)S(=O)(=O)Nc1ccc(cc1)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 C25H21ClN2O4S MW 480.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O4S/c26-17-8-4-15(5-9-17)24-21-3-1-2-20(21)22-14-19(12-13-23(22)27-24)33(31,32)28-18-10-6-16(7-11-18)25(29)30/h1-2,4-14,20-21,24,27-28H,3H2,(H,29,30)/t20-,21+,24+/m1/s1InChIKey
MKHLHZXTUGWPHE-DPLHUUCSSA-NSynonyms
4((((3aS4R9bR)4(4chlorophenyl)3a459btetrahydro3Hcyclopenta(c)quinolin8yl)sulfonyl)amino)benzoicacid
4(((3aS4R9bR)4(4chlorophenyl)3a459btetrahydro3Hcyclopenta(c)quinolin8yl)sulfonylamino)benzoicacid
C1C=CC2C1C(NC3=C2C=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)C(=O)O)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)(C@@H)1Nc2ccc(cc2(C@H)2(C@@H)1CC=C2)S(=O)(=O)Nc1ccc(cc1)C(=O)O
InChI=1SC25H21ClN2O4Sc26178415(5917)242131220(21)221419(121323(22)2724)33(3132)281810616(71118)25(29)30h124142021242728H3H2(H2930)t2021+24+m1s1
MFCD24857568
ZINC000014166026
ZINC14166026
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