N-tert-butyl-1-[1-[2-(2-methylphenoxy)ethanoylamino]-2-oxidanyl-4-phenyl-butyl]-2-pyridin-4-ylsulfanyl-piperidine-2-carboxamide

Systemtic Name: N-tert-butyl-1-[1-[2-(2-methylphenoxy)ethanoylamino]-2-oxidanyl-4-phenyl-butyl]-2-pyridin-4-ylsulfanyl-piperidine-2-carboxamide Openeye Name: N-tert-butyl-1-[2-hydroxy-1-[[2-(2-methylphenoxy)acetyl]amino]-4-phenyl-butyl]-2-(4-pyridylsulfanyl)piperidine-2-carboxamide CAS Name: N-tert-butyl-1-[2-hydroxy-1-[[2-(2-methylphenoxy)-1-oxoethyl]amino]-4-phenylbutyl]-2-(pyridin-4-ylthio)-2-piperidinecarboxamide IUPAC Name: N-tert-butyl-1-[2-hydroxy-1-[[2-(2-methylphenoxy)acetyl]amino]-4-phenylbutyl]-2-pyridin-4-ylsulfanylpiperidine-2-carboxamide Traditional Name: N-tert-butyl-1-[2-hydroxy-1-[[2-(2-methylphenoxy)acetyl]amino]-4-phenyl-butyl]-2-(4-pyridylthio)pipecolinamide Formula: C34H44N4O4S MolecularWeight: 604.80256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC(C(CCC2=CC=CC=C2)O)N3CCCCC3(C(=O)NC(C)(C)C)SC4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC(C(CCC2=CC=CC=C2)O)N3CCCCC3(C(=O)NC(C)(C)C)SC4=CC=NC=C4

InChI

InChI=1S/C34H44N4O4S/c1-25-12-8-9-15-29(25)42-24-30(40)36-31(28(39)17-16-26-13-6-5-7-14-26)38-23-11-10-20-34(38,32(41)37-33(2,3)4)43-27-18-21-35-22-19-27/h5-9,12-15,18-19,21-22,28,31,39H,10-11,16-17,20,23-24H2,1-4H3,(H,36,40)(H,37,41)