7-chloranyl-2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]methyl]-1H-quinazolin-4-one Formula: C24H23ClN6O2 MolecularWeight: 462.93142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC4=NC(=O)C5=C(N4)C=C(C=C5)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC4=NC(=O)C5=C(N4)C=C(C=C5)Cl

InChI

InChI=1S/C24H23ClN6O2/c1-14-21(15(2)31(29-14)17-6-4-3-5-7-17)22-24(33)26-10-11-30(22)13-20-27-19-12-16(25)8-9-18(19)23(32)28-20/h3-9,12,22H,10-11,13H2,1-2H3,(H,26,33)(H,27,28,32)