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

Systemtic Name: 2-ethanimidoyl-4-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[[1-(4-methoxyphenyl)-5-tetrazolyl]thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[[1-(4-methoxyphenyl)tetrazol-5-yl]thio]butyronitrile Formula: C14H14N6O2S MolecularWeight: 330.36496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=NN1C2=CC=C(C=C2)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=NN1C2=CC=C(C=C2)OC

InChI

InChI=1S/C14H14N6O2S/c1-9(16)12(7-15)13(21)8-23-14-17-18-19-20(14)10-3-5-11(22-2)6-4-10/h3-6,12,16H,8H2,1-2H3