4-[2-(2-chloranyl-4-fluoranyl-phenyl)sulfanylethanoylamino]-N-[2-(2-naphthalen-1-ylethanoylamino)ethyl]piperidine-4-carboxamide

Systemtic Name: 4-[2-(2-chloranyl-4-fluoranyl-phenyl)sulfanylethanoylamino]-N-[2-(2-naphthalen-1-ylethanoylamino)ethyl]piperidine-4-carboxamide Openeye Name: 4-[[2-(2-chloro-4-fluoro-phenyl)sulfanylacetyl]amino]-N-[2-[[2-(1-naphthyl)acetyl]amino]ethyl]piperidine-4-carboxamide CAS Name: 4-[[2-[(2-chloro-4-fluorophenyl)thio]-1-oxoethyl]amino]-N-[2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]ethyl]-4-piperidinecarboxamide IUPAC Name: 4-[[2-(2-chloro-4-fluorophenyl)sulfanylacetyl]amino]-N-[2-[(2-naphthalen-1-ylacetyl)amino]ethyl]piperidine-4-carboxamide Traditional Name: 4-[[2-[(2-chloro-4-fluoro-phenyl)thio]acetyl]amino]-N-[2-[[2-(1-naphthyl)acetyl]amino]ethyl]isonipecotamide Formula: C28H30ClFN4O3S MolecularWeight: 557.079203

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(=O)NCCNC(=O)CC2=CC=CC3=CC=CC=C32)NC(=O)CSC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CNCCC1(C(=O)NCCNC(=O)CC2=CC=CC3=CC=CC=C32)NC(=O)CSC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C28H30ClFN4O3S/c29-23-17-21(30)8-9-24(23)38-18-26(36)34-28(10-12-31-13-11-28)27(37)33-15-14-32-25(35)16-20-6-3-5-19-4-1-2-7-22(19)20/h1-9,17,31H,10-16,18H2,(H,32,35)(H,33,37)(H,34,36)