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

Systemtic Name: 3-phenyl-1-[5-[(phenylmethyl)amino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]prop-2-en-1-one Openeye Name: 1-[5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: 3-phenyl-1-[5-[(phenylmethyl)amino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-2-propen-1-one IUPAC Name: 1-[5-(benzylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one Traditional Name: 1-[5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one Formula: C23H19N5O MolecularWeight: 381.42986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N5O/c29-21(14-13-18-8-3-1-4-9-18)28-23(25-16-19-10-5-2-6-11-19)26-22(27-28)20-12-7-15-24-17-20/h1-15,17H,16H2,(H,25,26,27)