2-chloranyl-5-piperidin-1-ylsulfonyl-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide

Systemtic Name: 2-chloranyl-5-piperidin-1-ylsulfonyl-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide Openeye Name: 2-chloro-5-(1-piperidylsulfonyl)-N-[2-(3-pyridylmethylcarbamoyl)phenyl]benzamide CAS Name: 2-chloro-N-[2-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-5-piperidin-1-ylsulfonyl-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide Traditional Name: 2-chloro-5-piperidinosulfonyl-N-[2-(3-pyridylmethylcarbamoyl)phenyl]benzamide Formula: C25H25ClN4O4S MolecularWeight: 513.0084

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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=C3C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C25H25ClN4O4S/c26-22-11-10-19(35(33,34)30-13-4-1-5-14-30)15-21(22)25(32)29-23-9-3-2-8-20(23)24(31)28-17-18-7-6-12-27-16-18/h2-3,6-12,15-16H,1,4-5,13-14,17H2,(H,28,31)(H,29,32)