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

Systemtic Name: 2-ethanimidoyl-4-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[[4-methyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[[4-methyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]butyronitrile Formula: C14H15N5OS2 MolecularWeight: 333.4318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1C)CC2=CC=CS2

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1C)CC2=CC=CS2

InChI

InChI=1S/C14H15N5OS2/c1-9(16)11(7-15)12(20)8-22-14-18-17-13(19(14)2)6-10-4-3-5-21-10/h3-5,11,16H,6,8H2,1-2H3