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

Systemtic Name: 2-ethanimidoyl-4-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]butyronitrile Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=CN1C2=CC(=CC=C2)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=CN1C2=CC(=CC=C2)OC

InChI

InChI=1S/C15H15N5O2S/c1-10(17)13(7-16)14(21)8-23-15-19-18-9-20(15)11-4-3-5-12(6-11)22-2/h3-6,9,13,17H,8H2,1-2H3