2-[4-(6-chloranylnaphthalen-2-yl)sulfonylbutyl]-1-pyridin-4-yl-piperidine-4-carboxamide

Systemtic Name: 2-[4-(6-chloranylnaphthalen-2-yl)sulfonylbutyl]-1-pyridin-4-yl-piperidine-4-carboxamide Openeye Name: 2-[4-[(6-chloro-2-naphthyl)sulfonyl]butyl]-1-(4-pyridyl)piperidine-4-carboxamide CAS Name: 2-[4-[(6-chloro-2-naphthalenyl)sulfonyl]butyl]-1-pyridin-4-yl-4-piperidinecarboxamide IUPAC Name: 2-[4-(6-chloronaphthalen-2-yl)sulfonylbutyl]-1-pyridin-4-ylpiperidine-4-carboxamide Traditional Name: 2-[4-[(6-chloro-2-naphthyl)sulfonyl]butyl]-1-(4-pyridyl)isonipecotamide Formula: C25H28ClN3O3S MolecularWeight: 486.02612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1C(=O)N)CCCCS(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

C1CN(C(CC1C(=O)N)CCCCS(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C25H28ClN3O3S/c26-21-6-4-19-17-24(7-5-18(19)15-21)33(31,32)14-2-1-3-23-16-20(25(27)30)10-13-29(23)22-8-11-28-12-9-22/h4-9,11-12,15,17,20,23H,1-3,10,13-14,16H2,(H2,27,30)