N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-cyanophenyl)-2-[[5-keto-4-(3-methoxypropyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C15H17N5O3S MolecularWeight: 347.39218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)NN=C1SCC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

COCCCN1C(=O)NN=C1SCC(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H17N5O3S/c1-23-8-2-7-20-14(22)18-19-15(20)24-10-13(21)17-12-5-3-11(9-16)4-6-12/h3-6H,2,7-8,10H2,1H3,(H,17,21)(H,18,22)