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

Systemtic Name: hexyl 2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: hexyl 2-(4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)acetic acid hexyl ester IUPAC Name: hexyl 2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid hexyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC(=O)CN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S/c1-2-3-4-8-11-25-18(23)13-22-14-21-19-16(20(22)24)12-17(26-19)15-9-6-5-7-10-15/h5-7,9-10,12,14H,2-4,8,11,13H2,1H3