Vitas-M small molecule compound
2-{[7-methoxy-1-(methoxycarbonyl)-4,5-dihydronaphtho[2,1-b]thiophen-2-yl]carbamoyl}cyclohexanecarboxylic acid
Catalog ID
STK471114
SMILES COC(=O)c1c(NC(=O)C2CCCCC2C(=O)O)sc2c1c1ccc(cc1CC2)OC
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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 C23H25NO6S MW 443.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO6S/c1-29-13-8-9-14-12(11-13)7-10-17-18(14)19(23(28)30-2)21(31-17)24-20(25)15-5-3-4-6-16(15)22(26)27/h8-9,11,15-16H,3-7,10H2,1-2H3,(H,24,25)(H,26,27)InChIKey
KRYNIABVMOXGHP-UHFFFAOYSA-NSynonyms
2((7methoxy1(methoxycarbonyl)45dihydronaphtho(21b)thiophen2yl)carbamoyl)cyclohexanecarboxylicacid
2((7methoxy1methoxycarbonyl45dihydrobenzo(e)(1)benzothiol2yl)carbamoyl)cyclohexane1carboxylicacid
2(N(7METHOXY1(METHOXYCARBONYL)45DIHYDROBENZO(E)BENZO(B)THIOPHEN2YL)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
COC1=CC2=C(C=C1)C3=C(CC2)SC(=C3C(=O)OC)NC(=O)C4CCCCC4C(=O)O
InChI=1SC23H25NO6Sc12913891412(1113)7101718(14)19(23(28)302)21(3117)2420(25)15534616(15)22(26)27h89111516H3710H212H3(H2425)(H2627)
MFCD06022418
ZINC000019638399
ZINC000019638412
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