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

Systemtic Name: 2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-piperidin-1-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[[1-(1-piperidyl)cyclohexyl]methyl]acetamide CAS Name: 2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[[1-(1-piperidinyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(1-piperidinocyclohexyl)methyl]acetamide Formula: C23H33N5OS MolecularWeight: 427.60602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=O)NCC3(CCCCC3)N4CCCCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=O)NCC3(CCCCC3)N4CCCCC4

InChI

InChI=1S/C23H33N5OS/c1-18-9-8-10-19(15-18)21-25-26-22(30)28(21)16-20(29)24-17-23(11-4-2-5-12-23)27-13-6-3-7-14-27/h8-10,15H,2-7,11-14,16-17H2,1H3,(H,24,29)(H,26,30)