phenyl 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanesulfonate

Systemtic Name: phenyl 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanesulfonate Openeye Name: phenyl 2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanesulfonate CAS Name: 2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)ethanesulfonate Traditional Name: 2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanesulfonic acid phenyl ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCS(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCS(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C20H16N2O4S2/c23-20-18-17(15-7-3-1-4-8-15)13-27-19(18)21-14-22(20)11-12-28(24,25)26-16-9-5-2-6-10-16/h1-10,13-14H,11-12H2