1-ethanoyl-3-(4-methylphenyl)-6-(1H-pyrrol-2-yl)-2,6-dihydro-1,2,4-triazin-5-one

Systemtic Name: 1-ethanoyl-3-(4-methylphenyl)-6-(1H-pyrrol-2-yl)-2,6-dihydro-1,2,4-triazin-5-one Openeye Name: 1-acetyl-3-(p-tolyl)-6-(1H-pyrrol-2-yl)-2,6-dihydro-1,2,4-triazin-5-one CAS Name: 1-acetyl-3-(4-methylphenyl)-6-(1H-pyrrol-2-yl)-2,6-dihydro-1,2,4-triazin-5-one IUPAC Name: 1-acetyl-3-(4-methylphenyl)-6-(1H-pyrrol-2-yl)-2,6-dihydro-1,2,4-triazin-5-one Traditional Name: 1-acetyl-3-(p-tolyl)-6-(1H-pyrrol-2-yl)-2,6-dihydro-1,2,4-triazin-5-one Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=O)C(N(N2)C(=O)C)C3=CC=CN3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=O)C(N(N2)C(=O)C)C3=CC=CN3

InChI

InChI=1S/C16H16N4O2/c1-10-5-7-12(8-6-10)15-18-16(22)14(13-4-3-9-17-13)20(19-15)11(2)21/h3-9,14,17H,1-2H3,(H,18,19,22)