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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC(C)C(=O)N(CC2=CC=CC=C2)C3=NC=NN3

Isomeric SMILES

CC1=CC(=CC=C1)CSC(C)C(=O)N(CC2=CC=CC=C2)C3=NC=NN3

InChI

InChI=1S/C20H22N4OS/c1-15-7-6-10-18(11-15)13-26-16(2)19(25)24(20-21-14-22-23-20)12-17-8-4-3-5-9-17/h3-11,14,16H,12-13H2,1-2H3,(H,21,22,23)