methyl 5-(diethylcarbamoyl)-2-[(4,6-dimethylpyridin-2-yl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-[(4,6-dimethylpyridin-2-yl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-[(4,6-dimethyl-2-pyridyl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[[(4,6-dimethyl-2-pyridinyl)amino]-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-[(4,6-dimethylpyridin-2-yl)carbamothioylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[(4,6-dimethyl-2-pyridyl)thiocarbamoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H26N4O3S2 MolecularWeight: 434.57544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=CC(=CC(=N2)C)C)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=CC(=CC(=N2)C)C)C(=O)OC)C

InChI

InChI=1S/C20H26N4O3S2/c1-7-24(8-2)18(25)16-13(5)15(19(26)27-6)17(29-16)23-20(28)22-14-10-11(3)9-12(4)21-14/h9-10H,7-8H2,1-6H3,(H2,21,22,23,28)