methyl 5-(diethylcarbamoyl)-4-methyl-2-[(4-methylpyridin-2-yl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-4-methyl-2-[(4-methylpyridin-2-yl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-4-methyl-2-[(4-methyl-2-pyridyl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-4-methyl-2-[[[(4-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-4-methyl-2-[(4-methylpyridin-2-yl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-4-methyl-2-[(4-methyl-2-pyridyl)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C19H24N4O3S2 MolecularWeight: 420.54886

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=NC=CC(=C2)C)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=NC=CC(=C2)C)C(=O)OC)C

InChI

InChI=1S/C19H24N4O3S2/c1-6-23(7-2)17(24)15-12(4)14(18(25)26-5)16(28-15)22-19(27)21-13-10-11(3)8-9-20-13/h8-10H,6-7H2,1-5H3,(H2,20,21,22,27)