2-[[4-[4-cyclohexyl-2-(ethylsulfanylmethyl)butyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: 2-[[4-[4-cyclohexyl-2-(ethylsulfanylmethyl)butyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: 2-[[4-[4-cyclohexyl-2-(ethylsulfanylmethyl)butyl]-2-(o-tolyl)benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[4-[4-cyclohexyl-2-[(ethylthio)methyl]butyl]-2-(2-methylphenyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: 2-[[4-[4-cyclohexyl-2-(ethylsulfanylmethyl)butyl]-2-(2-methylphenyl)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[4-[4-cyclohexyl-2-[(ethylthio)methyl]butyl]-2-(o-tolyl)benzoyl]amino]-4-(methylthio)butyrate Formula: C32H44NO3S2- MolecularWeight: 554.82666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSCC(CCC1CCCCC1)CC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)[O-])C3=CC=CC=C3C

Isomeric SMILES

CCSCC(CCC1CCCCC1)CC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)[O-])C3=CC=CC=C3C

InChI

InChI=1S/C32H45NO3S2/c1-4-38-22-26(15-14-24-11-6-5-7-12-24)20-25-16-17-28(29(21-25)27-13-9-8-10-23(27)2)31(34)33-30(32(35)36)18-19-37-3/h8-10,13,16-17,21,24,26,30H,4-7,11-12,14-15,18-20,22H2,1-3H3,(H,33,34)(H,35,36)/p-1