2-[[3-ethanoylsulfanyl-4-(4-methoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[[3-ethanoylsulfanyl-4-(4-methoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[[3-acetylsulfanyl-4-(4-methoxyphenyl)-4-oxo-butanoyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[3-(acetylthio)-4-(4-methoxyphenyl)-1,4-dioxobutyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[3-acetylsulfanyl-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[3-(acetylthio)-4-keto-4-(4-methoxyphenyl)butanoyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C24H24N2O6S MolecularWeight: 468.52216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)SC(CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H24N2O6S/c1-14(27)33-21(23(29)15-7-9-17(32-2)10-8-15)12-22(28)26-20(24(30)31)11-16-13-25-19-6-4-3-5-18(16)19/h3-10,13,20-21,25H,11-12H2,1-2H3,(H,26,28)(H,30,31)