ethyl 2-azanyl-4-methyl-5-[(E)-C-methyl-N-[(2-oxidanyl-2,2-diphenyl-ethanoyl)amino]carbonimidoyl]thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-methyl-5-[(E)-C-methyl-N-[(2-oxidanyl-2,2-diphenyl-ethanoyl)amino]carbonimidoyl]thiophene-3-carboxylate Openeye Name: ethyl 2-amino-5-[(E)-N-[(2-hydroxy-2,2-diphenyl-acetyl)amino]-C-methyl-carbonimidoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 2-amino-5-[(1E)-1-[(2-hydroxy-1-oxo-2,2-diphenylethyl)hydrazinylidene]ethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-[(E)-N-[(2-hydroxy-2,2-diphenylacetyl)amino]-C-methylcarbonimidoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-amino-5-[(E)-N-(benziloylamino)-C-methyl-carbonimidoyl]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H25N3O4S MolecularWeight: 451.538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=NNC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)/C(=N/NC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)/C)N

InChI

InChI=1S/C24H25N3O4S/c1-4-31-22(28)19-15(2)20(32-21(19)25)16(3)26-27-23(29)24(30,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,30H,4,25H2,1-3H3,(H,27,29)/b26-16+