Vitas-M small molecule compound
methyl 2-{[(3-ethoxyphenyl)carbonyl]amino}-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Catalog ID
STK424234
SMILES CCOc1cccc(c1)C(=O)Nc1sc2c(c1C(=O)OC)CCCCCCCCCC2
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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 C25H33NO4S MW 443.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33NO4S/c1-3-30-19-14-12-13-18(17-19)23(27)26-24-22(25(28)29-2)20-15-10-8-6-4-5-7-9-11-16-21(20)31-24/h12-14,17H,3-11,15-16H2,1-2H3,(H,26,27)InChIKey
YYNHSHGVQASPQY-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCCCCCCCC3)C(=O)OC
InChI=1SC25H33NO4Sc13301914121318(1719)23(27)262422(25(28)292)201510864579111621(20)3124h121417H3111516H212H3(H2627)
methyl2(((3ethoxyphenyl)carbonyl)amino)45678910111213decahydrocyclododeca(b)thiophene3carboxylate
methyl2((3ethoxybenzoyl)amino)45678910111213decahydrocyclododeca(b)thiophene3carboxylate
MFCD01922135
ZINC000002752449
ZINC02752449
ZINC2752449
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Check stock on Vitas-MAvailable files
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