dimethyl 5-[(furan-2-ylcarbonylamino)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[(furan-2-ylcarbonylamino)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[(furan-2-carbonylamino)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[[2-furanyl(oxo)methyl]hydrazo]-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(furan-2-carbonylamino)carbamothioylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(2-furoylamino)thiocarbamoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H15N3O6S2 MolecularWeight: 397.4261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)C2=CC=CO2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)C2=CC=CO2)C(=O)OC

InChI

InChI=1S/C15H15N3O6S2/c1-7-9(13(20)22-2)12(26-10(7)14(21)23-3)16-15(25)18-17-11(19)8-5-4-6-24-8/h4-6H,1-3H3,(H,17,19)(H2,16,18,25)