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

Systemtic Name: ethyl 5-phenyl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanoylamino)thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)propyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanoylamino)thiophene-3-carboxylate Traditional Name: 5-phenyl-2-[2-(thieno[2,3-d]pyrimidin-4-ylthio)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C22H19N3O3S3 MolecularWeight: 469.59956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NC=NC4=C3C=CS4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C22H19N3O3S3/c1-3-28-22(27)16-11-17(14-7-5-4-6-8-14)31-21(16)25-18(26)13(2)30-20-15-9-10-29-19(15)23-12-24-20/h4-13H,3H2,1-2H3,(H,25,26)