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

Systemtic Name: N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-cyanophenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-cyanophenyl)-2-[[5-keto-4-(3-methoxypropyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)SC2=NNC(=O)N2CCCOC

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C#N)SC2=NNC(=O)N2CCCOC

InChI

InChI=1S/C16H19N5O3S/c1-11(14(22)18-13-6-4-12(10-17)5-7-13)25-16-20-19-15(23)21(16)8-3-9-24-2/h4-7,11H,3,8-9H2,1-2H3,(H,18,22)(H,19,23)