2,2-dimethyl-1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[5-(p-tolylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]propan-1-one CAS Name: 2,2-dimethyl-1-[5-[(4-methylphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]propan-1-one Traditional Name: 2,2-dimethyl-1-[5-[(4-methylbenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]propan-1-one Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O/c1-14-7-9-15(10-8-14)12-22-19-23-17(16-6-5-11-21-13-16)24-25(19)18(26)20(2,3)4/h5-11,13H,12H2,1-4H3,(H,22,23,24)