N-[4-[2-(tert-butylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfanyl-3-oxidanyl-butan-2-yl]naphthalene-1-carboxamide

Systemtic Name: N-[4-[2-(tert-butylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfanyl-3-oxidanyl-butan-2-yl]naphthalene-1-carboxamide Openeye Name: N-[3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-1-(2-naphthylsulfanylmethyl)propyl]naphthalene-1-carboxamide CAS Name: N-[4-[2-[(tert-butylamino)-oxomethyl]phenyl]-3-hydroxy-1-(2-naphthalenylthio)butan-2-yl]-1-naphthalenecarboxamide IUPAC Name: N-[4-[2-(tert-butylcarbamoyl)phenyl]-3-hydroxy-1-naphthalen-2-ylsulfanylbutan-2-yl]naphthalene-1-carboxamide Traditional Name: N-[3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-1-[(2-naphthylthio)methyl]propyl]-1-naphthamide Formula: C36H36N2O3S MolecularWeight: 576.74764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=CC=C1CC(C(CSC2=CC3=CC=CC=C3C=C2)NC(=O)C4=CC=CC5=CC=CC=C54)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=CC=C1CC(C(CSC2=CC3=CC=CC=C3C=C2)NC(=O)C4=CC=CC5=CC=CC=C54)O

InChI

InChI=1S/C36H36N2O3S/c1-36(2,3)38-35(41)30-17-9-7-14-27(30)22-33(39)32(23-42-28-20-19-24-11-4-5-13-26(24)21-28)37-34(40)31-18-10-15-25-12-6-8-16-29(25)31/h4-21,32-33,39H,22-23H2,1-3H3,(H,37,40)(H,38,41)