Vitas-M small molecule compound
6-({3-[(3-chlorophenyl)carbamoyl]-4-ethyl-5-methylthiophen-2-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK471307
SMILES CCc1c(C)sc(c1C(=O)Nc1cccc(c1)Cl)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 C22H23ClN2O4S MW 446.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O4S/c1-3-15-12(2)30-21(18(15)20(27)24-14-8-6-7-13(23)11-14)25-19(26)16-9-4-5-10-17(16)22(28)29/h4-8,11,16-17H,3,9-10H2,1-2H3,(H,24,27)(H,25,26)(H,28,29)InChIKey
LLVBRURBXHIBMA-UHFFFAOYSA-NSynonyms
6((3((3chlorophenyl)carbamoyl)4ethyl5methylthiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6(N(3(N(3CHLOROPHENYL)CARBAMOYL)4ETHYL5METHYL2THIENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CCC1=C(SC(=C1C(=O)NC2=CC(=CC=C2)Cl)NC(=O)C3CC=CCC3C(=O)O)C
InChI=1SC22H23ClN2O4Sc131512(2)3021(18(15)20(27)241486713(23)1114)2519(26)169451017(16)22(28)29h48111617H3910H212H3(H2427)(H2526)(H2829)
MFCD06025120
ZINC000019645447
ZINC000019645453
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