methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[(2-methylfuran-3-yl)carbonylamino]carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[(2-methylfuran-3-yl)carbonylamino]carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[(2-methylfuran-3-carbonyl)amino]carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[[[(2-methyl-3-furanyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[(2-methylfuran-3-carbonyl)amino]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-4-methyl-2-[[(2-methyl-3-furoyl)amino]thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C17H20N4O5S2 MolecularWeight: 424.4945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O5S2/c1-8-11(16(24)25-5)14(28-12(8)15(23)21(3)4)18-17(27)20-19-13(22)10-6-7-26-9(10)2/h6-7H,1-5H3,(H,19,22)(H2,18,20,27)