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

Systemtic Name: 3-[2-(5-chloranyl-1H-indol-3-yl)ethylamino]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-(5-chloro-1H-indol-3-yl)ethylamino]-6-(p-tolyl)-2H-1,2,4-triazin-5-one CAS Name: 3-[2-(5-chloro-1H-indol-3-yl)ethylamino]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-(5-chloro-1H-indol-3-yl)ethylamino]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-[2-(5-chloro-1H-indol-3-yl)ethylamino]-6-(p-tolyl)-2H-1,2,4-triazin-5-one Formula: C20H18ClN5O MolecularWeight: 379.84282

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClN5O/c1-12-2-4-13(5-3-12)18-19(27)24-20(26-25-18)22-9-8-14-11-23-17-7-6-15(21)10-16(14)17/h2-7,10-11,23H,8-9H2,1H3,(H2,22,24,26,27)