Vitas-M small molecule compound
ethyl 2-({[(2E)-2-(4-ethoxybenzylidene)hydrazinyl](oxo)acetyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STL161251
SMILES CCOc1ccc(cc1)/C=N/NC(=O)C(=O)Nc1sc2c(c1C(=O)OCC)CCCCC2
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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 C23H27N3O5S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O5S/c1-3-30-16-12-10-15(11-13-16)14-24-26-21(28)20(27)25-22-19(23(29)31-4-2)17-8-6-5-7-9-18(17)32-22/h10-14H,3-9H2,1-2H3,(H,25,27)(H,26,28)/b24-14+InChIKey
BPPOZWNTDRVDPS-ZVHZXABRSA-NSynonyms
847367-75-3(E)ethyl2(2(2(4ethoxybenzylidene)hydrazinyl)2oxoacetamido)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
847367753
CCOC1=CC=C(C=C1)C=NNC(=O)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OCC
CCOc1ccc(cc1)C=NNC(=O)C(=O)Nc1sc2c(c1C(=O)OCC)CCCCC2
ethyl2((((2E)2(4ethoxybenzylidene)hydrazinyl)(oxo)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((2((2E)2((4ethoxyphenyl)methylidene)hydrazinyl)2oxoacetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC23H27N3O5Sc133016121015(111316)14242621(28)20(27)252219(23(29)3142)178657918(17)3222h1014H39H212H3(H2527)(H2628)b2414+
MFCD03885569
ZINC000002234737
ZINC33351258
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