N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-1-quinolin-8-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-1-quinolin-8-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(4-benzyl-1-piperidyl)ethyl]-1-(8-quinolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-1-(8-quinolinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(4-benzylpiperidin-1-yl)ethyl]-1-quinolin-8-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(4-benzylpiperidino)ethyl]-1-(8-quinolylsulfonyl)isonipecotamide Formula: C29H36N4O3S MolecularWeight: 520.68614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C29H36N4O3S/c34-29(31-16-21-32-17-11-24(12-18-32)22-23-6-2-1-3-7-23)26-13-19-33(20-14-26)37(35,36)27-10-4-8-25-9-5-15-30-28(25)27/h1-10,15,24,26H,11-14,16-22H2,(H,31,34)