Vitas-M small molecule compound
2-methoxy-5-{(E)-[(2E)-(5-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-4-oxo-1,3-thiazolidin-2-ylidene)hydrazinylidene]methyl}phenyl naphthalene-1-carboxylate
Catalog ID
STK382179
SMILES COc1ccc(cc1OC(=O)c1cccc2c1cccc2)/C=N/N=C/1\NC(=O)C(S1)CC(=O)Nc1ccc(cc1)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 C31H26N4O6S MW 582.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N4O6S/c1-39-22-13-11-21(12-14-22)33-28(36)17-27-29(37)34-31(42-27)35-32-18-19-10-15-25(40-2)26(16-19)41-30(38)24-9-5-7-20-6-3-4-8-23(20)24/h3-16,18,27H,17H2,1-2H3,(H,33,36)(H,34,35,37)/b32-18+InChIKey
BFIUJYRRFJETMB-KCSSXMTESA-NSynonyms
(2methoxy5((E)((5(2(4methoxyanilino)2oxoethyl)4oxo13thiazol2yl)hydrazinylidene)methyl)phenyl)naphthalene1carboxylate
2methoxy5((E)((2E)(5(2((4methoxyphenyl)amino)2oxoethyl)4oxo13thiazolidin2ylidene)hydrazinylidene)methyl)phenylnaphthalene1carboxylate
COC1=CC=C(C=C1)NC(=O)CC2C(=O)N=C(S2)NN=CC3=CC(=C(C=C3)OC)OC(=O)C4=CC=CC5=CC=CC=C54
COc1ccc(cc1OC(=O)c1cccc2c1cccc2)C=NN=C1NC(=O)C(S1)CC(=O)Nc1ccc(cc1)OC
InChI=1SC31H26N4O6Sc13922131121(121422)3328(36)172729(37)3431(4227)35321819101525(402)26(1619)4130(38)2495720634823(20)24h3161827H17H212H3(H3336)(H343537)b3218+
MFCD03103687
ZINC000059222136
ZINC000059222137
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