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

Systemtic Name: 2-methyl-1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]propan-1-one Openeye Name: 2-methyl-1-[5-(p-tolylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]propan-1-one CAS Name: 2-methyl-1-[5-[(4-methylphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-1-propanone IUPAC Name: 2-methyl-1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]propan-1-one Traditional Name: 2-methyl-1-[5-[(4-methylbenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]propan-1-one Formula: C19H21N5O MolecularWeight: 335.40294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O/c1-13(2)18(25)24-19(21-11-15-8-6-14(3)7-9-15)22-17(23-24)16-5-4-10-20-12-16/h4-10,12-13H,11H2,1-3H3,(H,21,22,23)