ethyl (5R)-4-oxidanylidene-5-(phenethyliminomethyl)-2-phenylazanyl-thiophene-3-carboxylate

Systemtic Name: ethyl (5R)-4-oxidanylidene-5-(phenethyliminomethyl)-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: ethyl (5R)-2-anilino-4-oxo-5-(phenethyliminomethyl)thiophene-3-carboxylate CAS Name: (5R)-2-anilino-4-oxo-5-(phenethyliminomethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5R)-2-anilino-4-oxo-5-(phenethyliminomethyl)thiophene-3-carboxylate Traditional Name: (5R)-2-anilino-4-keto-5-(phenethyliminomethyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(C1=O)C=NCCC2=CC=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(S[C@@H](C1=O)C=NCCC2=CC=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3S/c1-2-27-22(26)19-20(25)18(15-23-14-13-16-9-5-3-6-10-16)28-21(19)24-17-11-7-4-8-12-17/h3-12,15,18,24H,2,13-14H2,1H3/t18-/m1/s1