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

Systemtic Name: 4-[(2-chloranyl-7-methyl-quinolin-3-yl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Openeye Name: 4-[(2-chloro-7-methyl-3-quinolyl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one CAS Name: 4-[(2-chloro-7-methyl-3-quinolinyl)methyl]-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-piperazinone IUPAC Name: 4-[(2-chloro-7-methylquinolin-3-yl)methyl]-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperazin-2-one Traditional Name: 4-[(2-chloro-7-methyl-3-quinolyl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Formula: C26H26ClN5O MolecularWeight: 459.97054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)CN3CCNC(=O)C3C4=C(N(N=C4C)C5=CC=CC=C5)C)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)CN3CCNC(=O)C3C4=C(N(N=C4C)C5=CC=CC=C5)C)Cl

InChI

InChI=1S/C26H26ClN5O/c1-16-9-10-19-14-20(25(27)29-22(19)13-16)15-31-12-11-28-26(33)24(31)23-17(2)30-32(18(23)3)21-7-5-4-6-8-21/h4-10,13-14,24H,11-12,15H2,1-3H3,(H,28,33)