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

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-[(4,6-dimethylpyrimidin-2-yl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-[(4,6-dimethylpyrimidin-2-yl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[[(4,6-dimethyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-[(4,6-dimethylpyrimidin-2-yl)carbamothioylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[(4,6-dimethylpyrimidin-2-yl)thiocarbamoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C19H25N5O3S2 MolecularWeight: 435.5635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O3S2/c1-7-24(8-2)16(25)14-12(5)13(17(26)27-6)15(29-14)22-19(28)23-18-20-10(3)9-11(4)21-18/h9H,7-8H2,1-6H3,(H2,20,21,22,23,28)