S-(2-oxidanylidene-2-phenylazanyl-ethyl) 4-phenylbenzenecarbothioate

Systemtic Name: S-(2-oxidanylidene-2-phenylazanyl-ethyl) 4-phenylbenzenecarbothioate Openeye Name: S-(2-anilino-2-oxo-ethyl) 4-phenylbenzenecarbothioate CAS Name: 4-phenylbenzenecarbothioic acid S-(2-anilino-2-oxoethyl) ester IUPAC Name: S-(2-anilino-2-oxoethyl) 4-phenylbenzenecarbothioate Traditional Name: 4-phenylthiobenzoic acid S-(2-anilino-2-keto-ethyl) ester Formula: C21H17NO2S MolecularWeight: 347.43018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H17NO2S/c23-20(22-19-9-5-2-6-10-19)15-25-21(24)18-13-11-17(12-14-18)16-7-3-1-4-8-16/h1-14H,15H2,(H,22,23)