2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclopentyl)methyl]ethanamide

Systemtic Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclopentyl)methyl]ethanamide Openeye Name: N-[(1-phenylcyclopentyl)methyl]-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclopentyl)methyl]acetamide IUPAC Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclopentyl)methyl]acetamide Traditional Name: N-[(1-phenylcyclopentyl)methyl]-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NCC3(CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NCC3(CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS/c1-17-9-11-18(12-10-17)21-25-26-22(29)27(21)15-20(28)24-16-23(13-5-6-14-23)19-7-3-2-4-8-19/h2-4,7-12H,5-6,13-16H2,1H3,(H,24,28)(H,26,29)