ethyl 2-[1-butyl-2,4-bis(oxidanylidene)-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[1-butyl-2,4-bis(oxidanylidene)-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]ethanoate Openeye Name: ethyl 2-(1-butyl-2,4-dioxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(1-butyl-2,4-dioxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(1-butyl-2,4-dioxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(1-butyl-2,4-diketo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=CS2)C3=CC=CC=C3)C(=O)N(C1=O)CC(=O)OCC

Isomeric SMILES

CCCCN1C2=C(C(=CS2)C3=CC=CC=C3)C(=O)N(C1=O)CC(=O)OCC

InChI

InChI=1S/C20H22N2O4S/c1-3-5-11-21-19-17(15(13-27-19)14-9-7-6-8-10-14)18(24)22(20(21)25)12-16(23)26-4-2/h6-10,13H,3-5,11-12H2,1-2H3