2-azanyl-2-[4-[(5-cyclohexylfuran-2-yl)methoxymethyl]-2-(2-methylphenyl)phenyl]carbonyl-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-azanyl-2-[4-[(5-cyclohexylfuran-2-yl)methoxymethyl]-2-(2-methylphenyl)phenyl]carbonyl-4-methylsulfanyl-butanoic acid Openeye Name: 2-amino-2-[4-[(5-cyclohexyl-2-furyl)methoxymethyl]-2-(o-tolyl)benzoyl]-4-methylsulfanyl-butanoic acid CAS Name: 2-amino-2-[[4-[(5-cyclohexyl-2-furanyl)methoxymethyl]-2-(2-methylphenyl)phenyl]-oxomethyl]-4-(methylthio)butanoic acid IUPAC Name: 2-amino-2-[4-[(5-cyclohexylfuran-2-yl)methoxymethyl]-2-(2-methylphenyl)benzoyl]-4-methylsulfanylbutanoic acid Traditional Name: 2-amino-2-[4-[(5-cyclohexyl-2-furyl)methoxymethyl]-2-(o-tolyl)benzoyl]-4-(methylthio)butyric acid Formula: C31H37NO5S MolecularWeight: 535.69418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)COCC3=CC=C(O3)C4CCCCC4)C(=O)C(CCSC)(C(=O)O)N

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)COCC3=CC=C(O3)C4CCCCC4)C(=O)C(CCSC)(C(=O)O)N

InChI

InChI=1S/C31H37NO5S/c1-21-8-6-7-11-25(21)27-18-22(12-14-26(27)29(33)31(32,30(34)35)16-17-38-2)19-36-20-24-13-15-28(37-24)23-9-4-3-5-10-23/h6-8,11-15,18,23H,3-5,9-10,16-17,19-20,32H2,1-2H3,(H,34,35)