Vitas-M small molecule compound
6-({5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK430798
SMILES CC(Cc1ccc(cc1)c1nc(sc1C)NC(=O)C1CC=CCC1C(=O)O)C
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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 C22H26N2O3S MW 398.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O3S/c1-13(2)12-15-8-10-16(11-9-15)19-14(3)28-22(23-19)24-20(25)17-6-4-5-7-18(17)21(26)27/h4-5,8-11,13,17-18H,6-7,12H2,1-3H3,(H,26,27)(H,23,24,25)InChIKey
WCAYKVUDNCORBO-UHFFFAOYSA-NSynonyms
6((5methyl4(4(2methylpropyl)phenyl)13thiazol2yl)carbamoyl)cyclohex3ene1carboxylicacid
6(N(5METHYL4(4(2METHYLPROPYL)PHENYL)13THIAZOL2YL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CC1=C(N=C(S1)NC(=O)C2CC=CCC2C(=O)O)C3=CC=C(C=C3)CC(C)C
InChI=1SC22H26N2O3Sc113(2)121581016(11915)1914(3)2822(2319)2420(25)17645718(17)21(26)27h45811131718H6712H213H3(H2627)(H232425)
MFCD03074530
ZINC000003864117
ZINC000004651909
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