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

Systemtic Name: N-cyclohexyl-2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-cyclohexyl-2-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-cyclohexyl-2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-cyclohexyl-2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-cyclohexyl-2-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC(C)C(=O)NC3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SC(C)C(=O)NC3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4OS/c1-17-13-15-21(16-14-17)28-22(19-9-5-3-6-10-19)26-27-24(28)30-18(2)23(29)25-20-11-7-4-8-12-20/h3,5-6,9-10,13-16,18,20H,4,7-8,11-12H2,1-2H3,(H,25,29)