[5-[(4-dimethylaminophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [5-[(4-dimethylaminophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-pyridin-3-yl-methanone Openeye Name: [5-[(4-dimethylaminophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-(3-pyridyl)methanone CAS Name: [5-[(4-dimethylaminophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-(3-pyridinyl)methanone IUPAC Name: [5-[(4-dimethylaminophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-pyridin-3-ylmethanone Traditional Name: [5-[[4-(dimethylamino)benzyl]amino]-3-phenyl-1,2,4-triazol-1-yl]-(3-pyridyl)methanone Formula: C23H22N6O MolecularWeight: 398.46038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N6O/c1-28(2)20-12-10-17(11-13-20)15-25-23-26-21(18-7-4-3-5-8-18)27-29(23)22(30)19-9-6-14-24-16-19/h3-14,16H,15H2,1-2H3,(H,25,26,27)