N-(4-cyanophenyl)-4-(1-methylimidazol-2-yl)sulfanyl-butanamide

Systemtic Name: N-(4-cyanophenyl)-4-(1-methylimidazol-2-yl)sulfanyl-butanamide Openeye Name: N-(4-cyanophenyl)-4-(1-methylimidazol-2-yl)sulfanyl-butanamide CAS Name: N-(4-cyanophenyl)-4-[(1-methyl-2-imidazolyl)thio]butanamide IUPAC Name: N-(4-cyanophenyl)-4-(1-methylimidazol-2-yl)sulfanylbutanamide Traditional Name: N-(4-cyanophenyl)-4-[(1-methylimidazol-2-yl)thio]butyramide Formula: C15H16N4OS MolecularWeight: 300.37874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCCC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CN1C=CN=C1SCCCC(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H16N4OS/c1-19-9-8-17-15(19)21-10-2-3-14(20)18-13-6-4-12(11-16)5-7-13/h4-9H,2-3,10H2,1H3,(H,18,20)