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

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

C1CCC(C1)C2=NC(=NN2)SCCC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

C1CCC(C1)C2=NC(=NN2)SCCC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C17H19N5OS/c18-11-13-7-3-4-8-14(13)19-15(23)9-10-24-17-20-16(21-22-17)12-5-1-2-6-12/h3-4,7-8,12H,1-2,5-6,9-10H2,(H,19,23)(H,20,21,22)