ethyl 5-aminocarbonyl-4-methyl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-4-methyl-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-4-methyl-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H16N4O4S3 MolecularWeight: 436.52834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CSC2=NC=NC3=C2C=CS3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CSC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C17H16N4O4S3/c1-3-25-17(24)11-8(2)12(13(18)23)28-16(11)21-10(22)6-27-15-9-4-5-26-14(9)19-7-20-15/h4-5,7H,3,6H2,1-2H3,(H2,18,23)(H,21,22)