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

Systemtic Name: N-(3-cyanophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(3-cyanophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(3-cyanophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(3-cyanophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(3-cyanophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H19N5OS MolecularWeight: 341.43066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)SC2=NNC(=N2)C3CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C#N)SC2=NNC(=N2)C3CCCC3

InChI

InChI=1S/C17H19N5OS/c1-11(16(23)19-14-8-4-5-12(9-14)10-18)24-17-20-15(21-22-17)13-6-2-3-7-13/h4-5,8-9,11,13H,2-3,6-7H2,1H3,(H,19,23)(H,20,21,22)