Vitas-M small molecule compound
ethyl 2-{[(4-nitrophenyl)carbonyl]amino}-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Catalog ID
STL170917
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc2c1CCCCCCCCCC2
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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 C24H30N2O5S MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O5S/c1-2-31-24(28)21-19-11-9-7-5-3-4-6-8-10-12-20(19)32-23(21)25-22(27)17-13-15-18(16-14-17)26(29)30/h13-16H,2-12H2,1H3,(H,25,27)InChIKey
ZLQUYLGDLLXZEX-UHFFFAOYSA-NSynonyms
353470-17-4353470174
CCOC(=O)C1=C(SC2=C1CCCCCCCCCC2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2ccc(cc2)(N+)(=O)(O))sc2c1CCCCCCCCCC2
ethyl2(((4nitrophenyl)carbonyl)amino)45678910111213decahydrocyclododeca(b)thiophene3carboxylate
ethyl2((4nitrobenzoyl)amino)45678910111213decahydrocyclododeca(b)thiophene3carboxylate
InChI=1SC24H30N2O5Sc123124(28)2119119753468101220(19)3223(21)2522(27)17131518(161417)26(29)30h1316H212H21H3(H2527)
MFCD01451981
ZINC000002771376
ZINC02771376
ZINC2771376
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