Vitas-M small molecule compound

6-{[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid

Catalog ID
STK425332
SMILES O=C(C1CC(=C(CC1C(=O)O)C)C)Nc1scc(n1)c1ccc(cc1)Cl

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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 C19H19ClN2O3S MW 390.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O3S/c1-10-7-14(15(18(24)25)8-11(10)2)17(23)22-19-21-16(9-26-19)12-3-5-13(20)6-4-12/h3-6,9,14-15H,7-8H2,1-2H3,(H,24,25)(H,21,22,23)
InChIKey
DKBMKSLNFMHPCW-UHFFFAOYSA-N
Synonyms

6((4(4chlorophenyl)13thiazol2yl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(N(4(4CHLOROPHENYL)(13THIAZOL2YL))CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl)C(=O)O)C
InChI=1SC19H19ClN2O3Sc110714(15(18(24)25)811(10)2)17(23)22192116(92619)123513(20)6412h3691415H78H212H3(H2425)(H212223)
MFCD02375269
ZINC000004651454
ZINC000004651458

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Available files

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