dimethyl 3-methyl-5-(pyridin-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-(pyridin-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-(2-pyridylcarbamothioylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(2-pyridinylamino)-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-(pyridin-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(2-pyridylthiocarbamoylamino)thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H15N3O4S2 MolecularWeight: 365.4273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC=N2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC=N2)C(=O)OC

InChI

InChI=1S/C15H15N3O4S2/c1-8-10(13(19)21-2)12(24-11(8)14(20)22-3)18-15(23)17-9-6-4-5-7-16-9/h4-7H,1-3H3,(H2,16,17,18,23)