Vitas-M small molecule compound
6-{[3-(cyclohexylcarbamoyl)-4-ethyl-5-methylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK471250
SMILES CCc1c(C)sc(c1C(=O)NC1CCCCC1)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 C22H30N2O4S MW 418.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N2O4S/c1-3-15-13(2)29-21(18(15)20(26)23-14-9-5-4-6-10-14)24-19(25)16-11-7-8-12-17(16)22(27)28/h7-8,14,16-17H,3-6,9-12H2,1-2H3,(H,23,26)(H,24,25)(H,27,28)InChIKey
GWDYEEJGOODYMP-UHFFFAOYSA-NSynonyms
6((3(cyclohexylcarbamoyl)4ethyl5methylthiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6(N(3(NCYCLOHEXYLCARBAMOYL)4ETHYL5METHYL2THIENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CCC1=C(SC(=C1C(=O)NC2CCCCC2)NC(=O)C3CC=CCC3C(=O)O)C
InChI=1SC22H30N2O4Sc131513(2)2921(18(15)20(26)231495461014)2419(25)1611781217(16)22(27)28h78141617H36912H212H3(H2326)(H2425)(H2728)
MFCD06025116
ZINC000017091514
ZINC000017091517
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