2-chloranyl-5-piperidin-1-ylsulfonyl-N-[3-(pyrazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: 2-chloranyl-5-piperidin-1-ylsulfonyl-N-[3-(pyrazol-1-ylmethyl)phenyl]benzamide Openeye Name: 2-chloro-5-(1-piperidylsulfonyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]benzamide CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)-N-[3-(1-pyrazolylmethyl)phenyl]benzamide IUPAC Name: 2-chloro-5-piperidin-1-ylsulfonyl-N-[3-(pyrazol-1-ylmethyl)phenyl]benzamide Traditional Name: 2-chloro-5-piperidinosulfonyl-N-[3-(pyrazol-1-ylmethyl)phenyl]benzamide Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC(=C3)CN4C=CC=N4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC(=C3)CN4C=CC=N4

InChI

InChI=1S/C22H23ClN4O3S/c23-21-9-8-19(31(29,30)27-12-2-1-3-13-27)15-20(21)22(28)25-18-7-4-6-17(14-18)16-26-11-5-10-24-26/h4-11,14-15H,1-3,12-13,16H2,(H,25,28)