2-methyl-1-[3-(4-methylphenyl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[3-(4-methylphenyl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]propan-1-one Openeye Name: 1-[5-(benzylamino)-3-(p-tolyl)-1,2,4-triazol-1-yl]-2-methyl-propan-1-one CAS Name: 2-methyl-1-[3-(4-methylphenyl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-1-propanone IUPAC Name: 1-[5-(benzylamino)-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-2-methylpropan-1-one Traditional Name: 1-[5-(benzylamino)-3-(p-tolyl)-1,2,4-triazol-1-yl]-2-methyl-propan-1-one Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CC=C3)C(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CC=C3)C(=O)C(C)C

InChI

InChI=1S/C20H22N4O/c1-14(2)19(25)24-20(21-13-16-7-5-4-6-8-16)22-18(23-24)17-11-9-15(3)10-12-17/h4-12,14H,13H2,1-3H3,(H,21,22,23)