2-[[4-[[5-(4-methanoylphenyl)furan-2-yl]-methoxy-methyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[4-[[5-(4-methanoylphenyl)furan-2-yl]-methoxy-methyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[4-[[5-(4-formylphenyl)-2-furyl]-methoxy-methyl]-2-(o-tolyl)benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[4-[[5-(4-formylphenyl)-2-furanyl]-methoxymethyl]-2-(2-methylphenyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[4-[[5-(4-formylphenyl)furan-2-yl]-methoxymethyl]-2-(2-methylphenyl)benzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[4-[[5-(4-formylphenyl)-2-furyl]-methoxy-methyl]-2-(o-tolyl)benzoyl]amino]-4-(methylthio)butyric acid Formula: C32H31NO6S MolecularWeight: 557.65664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)C(C3=CC=C(O3)C4=CC=C(C=C4)C=O)OC)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)C(C3=CC=C(O3)C4=CC=C(C=C4)C=O)OC)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C32H31NO6S/c1-20-6-4-5-7-24(20)26-18-23(12-13-25(26)31(35)33-27(32(36)37)16-17-40-3)30(38-2)29-15-14-28(39-29)22-10-8-21(19-34)9-11-22/h4-15,18-19,27,30H,16-17H2,1-3H3,(H,33,35)(H,36,37)