Vitas-M small molecule compound
2-{[3-(methoxycarbonyl)-5-methyl-4-(4-methylphenyl)thiophen-2-yl]carbamoyl}cyclohexanecarboxylic acid
Catalog ID
STK316548
SMILES COC(=O)c1c(NC(=O)C2CCCCC2C(=O)O)sc(c1c1ccc(cc1)C)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 C22H25NO5S MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO5S/c1-12-8-10-14(11-9-12)17-13(2)29-20(18(17)22(27)28-3)23-19(24)15-6-4-5-7-16(15)21(25)26/h8-11,15-16H,4-7H2,1-3H3,(H,23,24)(H,25,26)InChIKey
CYGFQQAUVZUPNV-UHFFFAOYSA-NSynonyms
445001-86-52((3(methoxycarbonyl)5methyl4(4methylphenyl)thiophen2yl)carbamoyl)cyclohexanecarboxylicacid
2((3METHOXYCARBONYL5METHYL4(4METHYLPHENYL)THIOPHEN2YL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
445001865
CC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3CCCCC3C(=O)O)C
InChI=1SC22H25NO5Sc11281014(11912)1713(2)2920(18(17)22(27)283)2319(24)15645716(15)21(25)26h8111516H47H213H3(H2324)(H2526)
MFCD02255177
ZINC000003864231
ZINC000003864234
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