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

Systemtic Name: 3-methyl-N-[[5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[[4-allyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[[5-[(4-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 3-methyl-N-[[5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: N-[[4-allyl-5-[(4-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C22H24N4OS/c1-4-12-26-20(14-23-21(27)19-7-5-6-17(3)13-19)24-25-22(26)28-15-18-10-8-16(2)9-11-18/h4-11,13H,1,12,14-15H2,2-3H3,(H,23,27)