[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-[1-(phenylmethyl)pyrazol-4-yl]methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-[1-(phenylmethyl)pyrazol-4-yl]methanone Openeye Name: (1-benzylpyrazol-4-yl)-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[1-(phenylmethyl)-4-pyrazolyl]methanone IUPAC Name: (1-benzylpyrazol-4-yl)-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone Traditional Name: (1-benzylpyrazol-4-yl)-[4-(5-chloro-2-methyl-phenyl)piperazino]methanone Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O/c1-17-7-8-20(23)13-21(17)25-9-11-26(12-10-25)22(28)19-14-24-27(16-19)15-18-5-3-2-4-6-18/h2-8,13-14,16H,9-12,15H2,1H3