3-[2-(5-methyl-1H-indol-3-yl)ethylamino]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[2-(5-methyl-1H-indol-3-yl)ethylamino]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-(5-methyl-1H-indol-3-yl)ethylamino]-6-(p-tolyl)-2H-1,2,4-triazin-5-one CAS Name: 3-[2-(5-methyl-1H-indol-3-yl)ethylamino]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-(5-methyl-1H-indol-3-yl)ethylamino]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-[2-(5-methyl-1H-indol-3-yl)ethylamino]-6-(p-tolyl)-2H-1,2,4-triazin-5-one Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=NC2=O)NCCC3=CNC4=C3C=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=NC2=O)NCCC3=CNC4=C3C=C(C=C4)C

InChI

InChI=1S/C21H21N5O/c1-13-3-6-15(7-4-13)19-20(27)24-21(26-25-19)22-10-9-16-12-23-18-8-5-14(2)11-17(16)18/h3-8,11-12,23H,9-10H2,1-2H3,(H2,22,24,26,27)