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

Systemtic Name: ethyl 4,5-dimethyl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H17N3O3S3 MolecularWeight: 407.53018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O3S3/c1-4-23-17(22)13-9(2)10(3)26-16(13)20-12(21)7-25-15-11-5-6-24-14(11)18-8-19-15/h5-6,8H,4,7H2,1-3H3,(H,20,21)