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

Systemtic Name: N-(3-cyanophenyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(3-cyanophenyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(3-cyanophenyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(3-cyanophenyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(3-cyanophenyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C19H23N5OS MolecularWeight: 369.48382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)SC2=NNC(=N2)CCC3CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C#N)SC2=NNC(=N2)CCC3CCCC3

InChI

InChI=1S/C19H23N5OS/c1-13(18(25)21-16-8-4-7-15(11-16)12-20)26-19-22-17(23-24-19)10-9-14-5-2-3-6-14/h4,7-8,11,13-14H,2-3,5-6,9-10H2,1H3,(H,21,25)(H,22,23,24)