[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-(3-phenyl-1H-pyrazol-5-yl)methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-(3-phenyl-1H-pyrazol-5-yl)methanone Formula: C21H21ClN4O MolecularWeight: 380.87064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C21H21ClN4O/c1-15-7-8-17(22)13-20(15)25-9-11-26(12-10-25)21(27)19-14-18(23-24-19)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3,(H,23,24)