4-chloranyl-2-(4-chlorophenyl)-1-methyl-5-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]pyrazol-3-one

Systemtic Name: 4-chloranyl-2-(4-chlorophenyl)-1-methyl-5-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]pyrazol-3-one Openeye Name: 4-chloro-2-(4-chlorophenyl)-1-methyl-5-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]pyrazol-3-one CAS Name: 4-chloro-2-(4-chlorophenyl)-1-methyl-5-[[4-(3-phenylpropyl)-1-piperazinyl]methyl]-3-pyrazolone IUPAC Name: 4-chloro-2-(4-chlorophenyl)-1-methyl-5-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]pyrazol-3-one Traditional Name: 4-chloro-2-(4-chlorophenyl)-1-methyl-5-[[4-(3-phenylpropyl)piperazino]methyl]-3-pyrazolin-3-one Formula: C24H28Cl2N4O MolecularWeight: 459.41132

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=C(C=C2)Cl)Cl)CN3CCN(CC3)CCCC4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=C(C=C2)Cl)Cl)CN3CCN(CC3)CCCC4=CC=CC=C4

InChI

InChI=1S/C24H28Cl2N4O/c1-27-22(23(26)24(31)30(27)21-11-9-20(25)10-12-21)18-29-16-14-28(15-17-29)13-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-12H,5,8,13-18H2,1H3