1-[3-chloranyl-6-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-5-pentanoyl-pyridin-2-yl]-N-(phenylmethyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: 1-[3-chloranyl-6-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-5-pentanoyl-pyridin-2-yl]-N-(phenylmethyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-benzylsulfonyl-1-[3-chloro-6-[(2-oxopyrrolidin-1-yl)methyl]-5-pentanoyl-2-pyridyl]piperidine-4-carboxamide CAS Name: 1-[3-chloro-5-(1-oxopentyl)-6-[(2-oxo-1-pyrrolidinyl)methyl]-2-pyridinyl]-N-(phenylmethyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-benzylsulfonyl-1-[3-chloro-6-[(2-oxopyrrolidin-1-yl)methyl]-5-pentanoylpyridin-2-yl]piperidine-4-carboxamide Traditional Name: N-benzylsulfonyl-1-[3-chloro-6-[(2-ketopyrrolidino)methyl]-5-valeryl-2-pyridyl]isonipecotamide Formula: C28H35ClN4O5S MolecularWeight: 575.1193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC(=C(N=C1CN2CCCC2=O)N3CCC(CC3)C(=O)NS(=O)(=O)CC4=CC=CC=C4)Cl

Isomeric SMILES

CCCCC(=O)C1=CC(=C(N=C1CN2CCCC2=O)N3CCC(CC3)C(=O)NS(=O)(=O)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C28H35ClN4O5S/c1-2-3-10-25(34)22-17-23(29)27(30-24(22)18-33-14-7-11-26(33)35)32-15-12-21(13-16-32)28(36)31-39(37,38)19-20-8-5-4-6-9-20/h4-6,8-9,17,21H,2-3,7,10-16,18-19H2,1H3,(H,31,36)