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

Systemtic Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Openeye Name: 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide CAS Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propanamide IUPAC Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Traditional Name: 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propionamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SC(C)C(=O)NCC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SC(C)C(=O)NCC(C)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4OS/c1-15-9-7-8-12-19(15)25-14-23-24-21(25)27-17(3)20(26)22-13-16(2)18-10-5-4-6-11-18/h4-12,14,16-17H,13H2,1-3H3,(H,22,26)