ethyl (5S)-4-oxidanylidene-2-phenylazanyl-5-[(phenylmethyl)iminomethyl]thiophene-3-carboxylate

Systemtic Name: ethyl (5S)-4-oxidanylidene-2-phenylazanyl-5-[(phenylmethyl)iminomethyl]thiophene-3-carboxylate Openeye Name: ethyl (5S)-2-anilino-5-(benzyliminomethyl)-4-oxo-thiophene-3-carboxylate CAS Name: (5S)-2-anilino-4-oxo-5-[(phenylmethyl)iminomethyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5S)-2-anilino-5-(benzyliminomethyl)-4-oxothiophene-3-carboxylate Traditional Name: (5S)-2-anilino-5-(benzyliminomethyl)-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(C1=O)C=NCC2=CC=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(S[C@H](C1=O)C=NCC2=CC=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-2-26-21(25)18-19(24)17(14-22-13-15-9-5-3-6-10-15)27-20(18)23-16-11-7-4-8-12-16/h3-12,14,17,23H,2,13H2,1H3/t17-/m0/s1