methyl 2-[2-[3-(furan-2-ylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[3-(furan-2-ylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-[3-(furan-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[[3-[[2-furanyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[3-(furan-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[[3-(2-furoylamino)phenyl]thio]acetyl]amino]benzoic acid methyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H18N2O5S/c1-27-21(26)16-8-2-3-9-17(16)23-19(24)13-29-15-7-4-6-14(12-15)22-20(25)18-10-5-11-28-18/h2-12H,13H2,1H3,(H,22,25)(H,23,24)