Vitas-M small molecule compound
6-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK317599
SMILES Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC(=O)C1CC=CCC1C(=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 C22H20N2O3S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O3S/c1-13-6-11-18-19(12-13)28-21(24-18)14-7-9-15(10-8-14)23-20(25)16-4-2-3-5-17(16)22(26)27/h2-3,6-12,16-17H,4-5H2,1H3,(H,23,25)(H,26,27)InChIKey
VVRPUWRAIBUXRZ-UHFFFAOYSA-NSynonyms
866821-21-86((4(6methyl13benzothiazol2yl)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
866821218
CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4CC=CCC4C(=O)O
InChI=1SC22H20N2O3Sc1136111819(1213)2821(2418)147915(10814)2320(25)16423517(16)22(26)27h236121617H45H21H3(H2325)(H2627)
MFCD06059113
ZINC000012649966
ZINC000012649980
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