2-[[5-cyclohexyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)propanamide

Systemtic Name: 2-[[5-cyclohexyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)propanamide Openeye Name: 2-[[5-cyclohexyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(o-tolyl)propanamide CAS Name: 2-[[5-cyclohexyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylphenyl)propanamide IUPAC Name: 2-[[5-cyclohexyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)propanamide Traditional Name: 2-[[5-cyclohexyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(o-tolyl)propionamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2C3=CC=CC=C3OC)C4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2C3=CC=CC=C3OC)C4CCCCC4

InChI

InChI=1S/C25H30N4O2S/c1-17-11-7-8-14-20(17)26-24(30)18(2)32-25-28-27-23(19-12-5-4-6-13-19)29(25)21-15-9-10-16-22(21)31-3/h7-11,14-16,18-19H,4-6,12-13H2,1-3H3,(H,26,30)