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

Systemtic Name: 2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-benzyl-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SC(C)C(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SC(C)C(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C20H22N4OS/c1-14-8-7-11-18(12-14)24-16(3)22-23-20(24)26-15(2)19(25)21-13-17-9-5-4-6-10-17/h4-12,15H,13H2,1-3H3,(H,21,25)