2-phenylethynyl (1Z)-2-oxidanylidene-N-phenylazanyl-propanimidothioate

Systemtic Name: 2-phenylethynyl (1Z)-2-oxidanylidene-N-phenylazanyl-propanimidothioate Openeye Name: 2-phenylethynyl (1Z)-N-anilino-2-oxo-propanimidothioate CAS Name: (1Z)-N-anilino-2-oxopropanimidothioic acid 2-phenylethynyl ester IUPAC Name: 2-phenylethynyl (1Z)-N-anilino-2-oxopropanimidothioate Traditional Name: (1Z)-N-anilino-2-keto-thiopropionimidic acid 2-phenylethynyl ester Formula: C17H14N2OS MolecularWeight: 294.37086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=NNC1=CC=CC=C1)SC#CC2=CC=CC=C2

Isomeric SMILES

CC(=O)/C(=N/NC1=CC=CC=C1)/SC#CC2=CC=CC=C2

InChI

InChI=1S/C17H14N2OS/c1-14(20)17(19-18-16-10-6-3-7-11-16)21-13-12-15-8-4-2-5-9-15/h2-11,18H,1H3/b19-17-