5-chloranyl-3-methyl-1-(phenylmethyl)-N-[3-(piperidin-1-ylmethyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-(phenylmethyl)-N-[3-(piperidin-1-ylmethyl)phenyl]pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-[3-(1-piperidylmethyl)phenyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-(phenylmethyl)-N-[3-(1-piperidinylmethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-[3-(piperidin-1-ylmethyl)phenyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-[3-(piperidinomethyl)phenyl]pyrazole-4-carboxamide Formula: C24H27ClN4O MolecularWeight: 422.95038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=CC(=C2)CN3CCCCC3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=CC(=C2)CN3CCCCC3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H27ClN4O/c1-18-22(23(25)29(27-18)17-19-9-4-2-5-10-19)24(30)26-21-12-8-11-20(15-21)16-28-13-6-3-7-14-28/h2,4-5,8-12,15H,3,6-7,13-14,16-17H2,1H3,(H,26,30)