6-[(4-propan-2-ylphenyl)methyl]-3-(pyridin-3-ylmethylamino)-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[(4-propan-2-ylphenyl)methyl]-3-(pyridin-3-ylmethylamino)-2H-1,2,4-triazin-5-one Openeye Name: 6-[(4-isopropylphenyl)methyl]-3-(3-pyridylmethylamino)-2H-1,2,4-triazin-5-one CAS Name: 6-[(4-propan-2-ylphenyl)methyl]-3-(3-pyridinylmethylamino)-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(4-propan-2-ylphenyl)methyl]-3-(pyridin-3-ylmethylamino)-2H-1,2,4-triazin-5-one Traditional Name: 6-(4-isopropylbenzyl)-3-(3-pyridylmethylamino)-2H-1,2,4-triazin-5-one Formula: C19H21N5O MolecularWeight: 335.40294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC2=NNC(=NC2=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC2=NNC(=NC2=O)NCC3=CN=CC=C3

InChI

InChI=1S/C19H21N5O/c1-13(2)16-7-5-14(6-8-16)10-17-18(25)22-19(24-23-17)21-12-15-4-3-9-20-11-15/h3-9,11,13H,10,12H2,1-2H3,(H2,21,22,24,25)