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

Systemtic Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclohexyl)methyl]propanamide Openeye Name: 3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclohexyl)methyl]propanamide CAS Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclohexyl)methyl]propanamide IUPAC Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclohexyl)methyl]propanamide Traditional Name: 3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclohexyl)methyl]propionamide Formula: C25H30N4OS MolecularWeight: 434.5969

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NCC3(CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NCC3(CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4OS/c1-19-9-8-10-20(17-19)23-27-28-24(31)29(23)16-13-22(30)26-18-25(14-6-3-7-15-25)21-11-4-2-5-12-21/h2,4-5,8-12,17H,3,6-7,13-16,18H2,1H3,(H,26,30)(H,28,31)