2-ethanimidoyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxidanylidene-butanenitrile

Systemtic Name: 2-ethanimidoyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]butyronitrile Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1C)C2=CC=CC=C2

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1C)C2=CC=CC=C2

InChI

InChI=1S/C15H15N5OS/c1-10(17)12(8-16)13(21)9-22-15-19-18-14(20(15)2)11-6-4-3-5-7-11/h3-7,12,17H,9H2,1-2H3