3-(3,4-dimethylphenyl)-4-oxidanyl-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1H-quinazolin-2-one

Systemtic Name: 3-(3,4-dimethylphenyl)-4-oxidanyl-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1H-quinazolin-2-one Openeye Name: 3-(3,4-dimethylphenyl)-4-hydroxy-4-[4-(2-pyridyl)piperazine-1-carbonyl]-1H-quinazolin-2-one CAS Name: 3-(3,4-dimethylphenyl)-4-hydroxy-4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-1H-quinazolin-2-one IUPAC Name: 3-(3,4-dimethylphenyl)-4-hydroxy-4-(4-pyridin-2-ylpiperazine-1-carbonyl)-1H-quinazolin-2-one Traditional Name: 3-(3,4-dimethylphenyl)-4-hydroxy-4-[4-(2-pyridyl)piperazine-1-carbonyl]-1H-quinazolin-2-one Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)NC3=CC=CC=C3C2(C(=O)N4CCN(CC4)C5=CC=CC=N5)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)NC3=CC=CC=C3C2(C(=O)N4CCN(CC4)C5=CC=CC=N5)O)C

InChI

InChI=1S/C26H27N5O3/c1-18-10-11-20(17-19(18)2)31-25(33)28-22-8-4-3-7-21(22)26(31,34)24(32)30-15-13-29(14-16-30)23-9-5-6-12-27-23/h3-12,17,34H,13-16H2,1-2H3,(H,28,33)