[3-[[4-[2-(tert-butylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfanyl-3-oxidanyl-butan-2-yl]carbamoyl]-2-methyl-phenyl]-methoxy-oxidanylidene-azanium

Systemtic Name: [3-[[4-[2-(tert-butylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfanyl-3-oxidanyl-butan-2-yl]carbamoyl]-2-methyl-phenyl]-methoxy-oxidanylidene-azanium Openeye Name: [3-[[3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-1-(2-naphthylsulfanylmethyl)propyl]carbamoyl]-2-methyl-phenyl]-methoxy-oxo-ammonium CAS Name: [3-[[[4-[2-[(tert-butylamino)-oxomethyl]phenyl]-3-hydroxy-1-(2-naphthalenylthio)butan-2-yl]amino]-oxomethyl]-2-methylphenyl]-methoxy-oxoammonium IUPAC Name: [3-[[4-[2-(tert-butylcarbamoyl)phenyl]-3-hydroxy-1-naphthalen-2-ylsulfanylbutan-2-yl]carbamoyl]-2-methylphenyl]-methoxy-oxoazanium Traditional Name: [3-[[3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-1-[(2-naphthylthio)methyl]propyl]carbamoyl]-2-methyl-phenyl]-keto-methoxy-ammonium Formula: C34H38N3O5S+ MolecularWeight: 600.74762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)OC)C(=O)NC(CSC2=CC3=CC=CC=C3C=C2)C(CC4=CC=CC=C4C(=O)NC(C)(C)C)O

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)OC)C(=O)NC(CSC2=CC3=CC=CC=C3C=C2)C(CC4=CC=CC=C4C(=O)NC(C)(C)C)O

InChI

InChI=1S/C34H37N3O5S/c1-22-27(15-10-16-30(22)37(41)42-5)32(39)35-29(21-43-26-18-17-23-11-6-7-12-24(23)19-26)31(38)20-25-13-8-9-14-28(25)33(40)36-34(2,3)4/h6-19,29,31,38H,20-21H2,1-5H3,(H-,35,36,39,40)/p+1