(4,5-diphenyl-1,2,4-triazol-3-yl) (1Z)-2-oxidanylidene-N-phenylazanyl-propanimidothioate

Systemtic Name: (4,5-diphenyl-1,2,4-triazol-3-yl) (1Z)-2-oxidanylidene-N-phenylazanyl-propanimidothioate Openeye Name: (4,5-diphenyl-1,2,4-triazol-3-yl) (1Z)-N-anilino-2-oxo-propanimidothioate CAS Name: (1Z)-N-anilino-2-oxopropanimidothioic acid (4,5-diphenyl-1,2,4-triazol-3-yl) ester IUPAC Name: (4,5-diphenyl-1,2,4-triazol-3-yl) (1Z)-N-anilino-2-oxopropanimidothioate Traditional Name: (1Z)-N-anilino-2-keto-thiopropionimidic acid (4,5-diphenyl-1,2,4-triazol-3-yl) ester Formula: C23H19N5OS MolecularWeight: 413.49486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=NNC1=CC=CC=C1)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)/C(=N/NC1=CC=CC=C1)/SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N5OS/c1-17(29)22(26-24-19-13-7-3-8-14-19)30-23-27-25-21(18-11-5-2-6-12-18)28(23)20-15-9-4-10-16-20/h2-16,24H,1H3/b26-22-