ethyl 5-methyl-4-phenyl-2-(thiophen-2-ylcarbonylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-4-phenyl-2-(thiophen-2-ylcarbonylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-4-phenyl-2-(thiophene-2-carbonylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 5-methyl-2-[[[[oxo(thiophen-2-yl)methyl]amino]-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-phenyl-2-(thiophene-2-carbonylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-methyl-4-phenyl-2-(2-thenoylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C20H18N2O3S3 MolecularWeight: 430.56352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NC(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H18N2O3S3/c1-3-25-19(24)16-15(13-8-5-4-6-9-13)12(2)28-18(16)22-20(26)21-17(23)14-10-7-11-27-14/h4-11H,3H2,1-2H3,(H2,21,22,23,26)