6-(1H-indol-3-yl)-1-(2-methylpropanoyl)-3-phenyl-2,6-dihydro-1,2,4-triazin-5-one

Systemtic Name: 6-(1H-indol-3-yl)-1-(2-methylpropanoyl)-3-phenyl-2,6-dihydro-1,2,4-triazin-5-one Openeye Name: 6-(1H-indol-3-yl)-1-(2-methylpropanoyl)-3-phenyl-2,6-dihydro-1,2,4-triazin-5-one CAS Name: 6-(1H-indol-3-yl)-1-(2-methyl-1-oxopropyl)-3-phenyl-2,6-dihydro-1,2,4-triazin-5-one IUPAC Name: 6-(1H-indol-3-yl)-1-(2-methylpropanoyl)-3-phenyl-2,6-dihydro-1,2,4-triazin-5-one Traditional Name: 6-(1H-indol-3-yl)-1-isobutyryl-3-phenyl-2,6-dihydro-1,2,4-triazin-5-one Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(C(=O)N=C(N1)C2=CC=CC=C2)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)C(=O)N1C(C(=O)N=C(N1)C2=CC=CC=C2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H20N4O2/c1-13(2)21(27)25-18(16-12-22-17-11-7-6-10-15(16)17)20(26)23-19(24-25)14-8-4-3-5-9-14/h3-13,18,22H,1-2H3,(H,23,24,26)