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

Systemtic Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-benzyl-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NNC(=N2)C3CCCC3

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)SC2=NNC(=N2)C3CCCC3

InChI

InChI=1S/C17H22N4OS/c1-12(16(22)18-11-13-7-3-2-4-8-13)23-17-19-15(20-21-17)14-9-5-6-10-14/h2-4,7-8,12,14H,5-6,9-11H2,1H3,(H,18,22)(H,19,20,21)