ethyl (5S)-5-[(4-chlorophenyl)methyliminomethyl]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate

Systemtic Name: ethyl (5S)-5-[(4-chlorophenyl)methyliminomethyl]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: ethyl (5S)-2-anilino-5-[(4-chlorophenyl)methyliminomethyl]-4-oxo-thiophene-3-carboxylate CAS Name: (5S)-2-anilino-5-[(4-chlorophenyl)methyliminomethyl]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5S)-2-anilino-5-[(4-chlorophenyl)methyliminomethyl]-4-oxothiophene-3-carboxylate Traditional Name: (5S)-2-anilino-5-[(4-chlorobenzyl)iminomethyl]-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O3S/c1-2-27-21(26)18-19(25)17(13-23-12-14-8-10-15(22)11-9-14)28-20(18)24-16-6-4-3-5-7-16/h3-11,13,17,24H,2,12H2,1H3/t17-/m0/s1