N-[2-[[2,3-bis(chloranyl)phenyl]methyl]pyrazol-3-yl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[[2,3-bis(chloranyl)phenyl]methyl]pyrazol-3-yl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(2,3-dichlorophenyl)methyl]pyrazol-3-yl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[(2,3-dichlorophenyl)methyl]-3-pyrazolyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-[(2,3-dichlorophenyl)methyl]pyrazol-3-yl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2,3-dichlorobenzyl)pyrazol-3-yl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C21H21Cl2N5O3S MolecularWeight: 494.39414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=NN2CC3=C(C(=CC=C3)Cl)Cl)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=NN2CC3=C(C(=CC=C3)Cl)Cl)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H21Cl2N5O3S/c22-18-5-1-3-16(20(18)23)14-28-19(6-10-25-28)26-21(29)15-7-11-27(12-8-15)32(30,31)17-4-2-9-24-13-17/h1-6,9-10,13,15H,7-8,11-12,14H2,(H,26,29)