ethyl 4,5-dimethyl-2-[(4-methylpyridin-2-yl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[(4-methylpyridin-2-yl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[(4-methyl-2-pyridyl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[[(4-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[(4-methylpyridin-2-yl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[(4-methyl-2-pyridyl)thiocarbamoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C16H19N3O2S2 MolecularWeight: 349.47096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NC2=NC=CC(=C2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NC2=NC=CC(=C2)C

InChI

InChI=1S/C16H19N3O2S2/c1-5-21-15(20)13-10(3)11(4)23-14(13)19-16(22)18-12-8-9(2)6-7-17-12/h6-8H,5H2,1-4H3,(H2,17,18,19,22)