3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-phenyl-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-phenyl-2H-1,2,4-triazin-5-one Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-phenyl-2H-1,2,4-triazin-5-one CAS Name: 3-[4-(2,3-dimethylphenyl)-1-piperazinyl]-6-phenyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-phenyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazino]-6-phenyl-2H-1,2,4-triazin-5-one Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC(=O)C(=NN3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC(=O)C(=NN3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H23N5O/c1-15-7-6-10-18(16(15)2)25-11-13-26(14-12-25)21-22-20(27)19(23-24-21)17-8-4-3-5-9-17/h3-10H,11-14H2,1-2H3,(H,22,24,27)