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

Systemtic Name: N-cyclohexyl-2-[[5-(3-methylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-cyclohexyl-2-[[5-(m-tolyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-cyclohexyl-2-[[5-(3-methylphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-cyclohexyl-2-[[5-(3-methylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-cyclohexyl-2-[[5-(m-tolyl)-4-phenyl-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=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SC(C)C(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SC(C)C(=O)NC4CCCCC4

InChI

InChI=1S/C24H28N4OS/c1-17-10-9-11-19(16-17)22-26-27-24(28(22)21-14-7-4-8-15-21)30-18(2)23(29)25-20-12-5-3-6-13-20/h4,7-11,14-16,18,20H,3,5-6,12-13H2,1-2H3,(H,25,29)