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

Systemtic Name: 3-(3-oxidanylpropylamino)-6-[(4-propan-2-ylphenyl)methyl]-2H-1,2,4-triazin-5-one Openeye Name: 3-(3-hydroxypropylamino)-6-[(4-isopropylphenyl)methyl]-2H-1,2,4-triazin-5-one CAS Name: 3-(3-hydroxypropylamino)-6-[(4-propan-2-ylphenyl)methyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-(3-hydroxypropylamino)-6-[(4-propan-2-ylphenyl)methyl]-2H-1,2,4-triazin-5-one Traditional Name: 3-(3-hydroxypropylamino)-6-(4-isopropylbenzyl)-2H-1,2,4-triazin-5-one Formula: C16H22N4O2 MolecularWeight: 302.37148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC2=NNC(=NC2=O)NCCCO

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC2=NNC(=NC2=O)NCCCO

InChI

InChI=1S/C16H22N4O2/c1-11(2)13-6-4-12(5-7-13)10-14-15(22)18-16(20-19-14)17-8-3-9-21/h4-7,11,21H,3,8-10H2,1-2H3,(H2,17,18,20,22)