N-[1-[4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: N-[1-[4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[1-[4-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]benzamide CAS Name: N-[1-[4-methyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: N-[1-[4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: N-[1-[4-methyl-5-[(4-methylbenzyl)thio]-1,2,4-triazol-3-yl]ethyl]benzamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C(C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C)C(C)NC(=O)C3=CC=CC=C3

InChI

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