phenyl 2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanesulfonate

Systemtic Name: phenyl 2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanesulfonate Openeye Name: phenyl 2-(4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanesulfonate CAS Name: 2-(4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)ethanesulfonate Traditional Name: 2-(4-keto-6-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=CC3=C(S2)N=CN(C3=O)CCS(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN(C3=O)CCS(=O)(=O)OC4=CC=CC=C4

InChI

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