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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)C(C#N)C(=N)C

InChI

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