1-[3-(4-methylphenyl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: 1-[3-(4-methylphenyl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: 1-[5-(benzylamino)-3-(p-tolyl)-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: 1-[3-(4-methylphenyl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-3-phenyl-2-propen-1-one IUPAC Name: 1-[5-(benzylamino)-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one Traditional Name: 1-[5-(benzylamino)-3-(p-tolyl)-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one Formula: C25H22N4O MolecularWeight: 394.46838

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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=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CC=C3)C(=O)C=CC4=CC=CC=C4

InChI

InChI=1S/C25H22N4O/c1-19-12-15-22(16-13-19)24-27-25(26-18-21-10-6-3-7-11-21)29(28-24)23(30)17-14-20-8-4-2-5-9-20/h2-17H,18H2,1H3,(H,26,27,28)