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

Systemtic Name: 2-ethanimidoyl-4-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]butyronitrile Formula: C16H17N5O2S MolecularWeight: 343.40348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1C)C2=CC=CC=C2OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1C)C2=CC=CC=C2OC

InChI

InChI=1S/C16H17N5O2S/c1-10(18)12(8-17)13(22)9-24-16-20-19-15(21(16)2)11-6-4-5-7-14(11)23-3/h4-7,12,18H,9H2,1-3H3