[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-(furan-2-ylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-(furan-2-ylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-(furan-2-carbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-(furan-2-carbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(2-furoylamino)-4,5-dimethoxy-benzoic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C25H26N2O7S MolecularWeight: 498.54814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NCCCSC2=CC=CC=C2)NC(=O)C3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NCCCSC2=CC=CC=C2)NC(=O)C3=CC=CO3)OC

InChI

InChI=1S/C25H26N2O7S/c1-31-21-14-18(19(15-22(21)32-2)27-24(29)20-10-6-12-33-20)25(30)34-16-23(28)26-11-7-13-35-17-8-4-3-5-9-17/h3-6,8-10,12,14-15H,7,11,13,16H2,1-2H3,(H,26,28)(H,27,29)