methyl 5-ethyl-2-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-ethyl-2-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[(2-methoxy-3-dibenzofuranyl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(2-methoxydibenzofuran-3-yl)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C22H20N2O4S2 MolecularWeight: 440.5352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC)C(=O)OC

InChI

InChI=1S/C22H20N2O4S2/c1-4-12-9-15(21(25)27-3)20(30-12)24-22(29)23-16-11-18-14(10-19(16)26-2)13-7-5-6-8-17(13)28-18/h5-11H,4H2,1-3H3,(H2,23,24,29)