N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1-(2-methylpropanoyl)piperidine-3-carboxamide

Systemtic Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1-(2-methylpropanoyl)piperidine-3-carboxamide Openeye Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1-(2-methylpropanoyl)piperidine-3-carboxamide CAS Name: N-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-N-methyl-1-(2-methyl-1-oxopropyl)-3-piperidinecarboxamide IUPAC Name: N-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-N-methyl-1-(2-methylpropanoyl)piperidine-3-carboxamide Traditional Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-isobutyryl-N-methyl-nipecotamide Formula: C27H31ClN4O2 MolecularWeight: 479.01364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)N1CCCC(C1)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C27H31ClN4O2/c1-19(2)26(33)31-15-7-8-21(17-31)27(34)30(3)16-22-18-32(24-9-5-4-6-10-24)29-25(22)20-11-13-23(28)14-12-20/h4-6,9-14,18-19,21H,7-8,15-17H2,1-3H3