N'-[(2R,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfanyl-3-oxidanyl-butan-2-yl]butanediamide

Systemtic Name: N'-[(2R,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfanyl-3-oxidanyl-butan-2-yl]butanediamide Openeye Name: N'-[(1R,2R)-3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-1-(2-naphthylsulfanylmethyl)propyl]butanediamide CAS Name: N'-[(2R,3R)-4-[2-[(tert-butylamino)-oxomethyl]phenyl]-3-hydroxy-1-(2-naphthalenylthio)butan-2-yl]butanediamide IUPAC Name: N'-[(2R,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-3-hydroxy-1-naphthalen-2-ylsulfanylbutan-2-yl]butanediamide Traditional Name: N'-[(1R,2R)-3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-1-[(2-naphthylthio)methyl]propyl]succinamide Formula: C29H35N3O4S MolecularWeight: 521.6709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=CC=C1CC(C(CSC2=CC3=CC=CC=C3C=C2)NC(=O)CCC(=O)N)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=CC=C1C[C@H]([C@H](CSC2=CC3=CC=CC=C3C=C2)NC(=O)CCC(=O)N)O

InChI

InChI=1S/C29H35N3O4S/c1-29(2,3)32-28(36)23-11-7-6-10-21(23)17-25(33)24(31-27(35)15-14-26(30)34)18-37-22-13-12-19-8-4-5-9-20(19)16-22/h4-13,16,24-25,33H,14-15,17-18H2,1-3H3,(H2,30,34)(H,31,35)(H,32,36)/t24-,25+/m0/s1