(E)-1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-3-phenyl-1-[5-(p-tolylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]prop-2-en-1-one CAS Name: (E)-1-[5-[(4-methylphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[5-[(4-methylbenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one Formula: C24H21N5O MolecularWeight: 395.45644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C=CC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)/C=C/C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C24H21N5O/c1-18-9-11-20(12-10-18)16-26-24-27-23(21-8-5-15-25-17-21)28-29(24)22(30)14-13-19-6-3-2-4-7-19/h2-15,17H,16H2,1H3,(H,26,27,28)/b14-13+