ethyl 3-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)benzofuran-2-carboxylate CAS Name: 3-[(4-thieno[2,3-d]pyrimidinylthio)methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-[(thieno[2,3-d]pyrimidin-4-ylthio)methyl]coumarilic acid ethyl ester Formula: C18H14N2O3S2 MolecularWeight: 370.44536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C18H14N2O3S2/c1-2-22-18(21)15-13(11-5-3-4-6-14(11)23-15)9-25-17-12-7-8-24-16(12)19-10-20-17/h3-8,10H,2,9H2,1H3