ethyl 2-[5-(4-bromophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[5-(4-bromophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoate Openeye Name: ethyl 2-[5-(4-bromophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetate CAS Name: 2-[5-(4-bromophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-bromophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetate Traditional Name: 2-[5-(4-bromophenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]acetic acid ethyl ester Formula: C16H13BrN2O3S MolecularWeight: 393.25502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H13BrN2O3S/c1-2-22-13(20)7-19-9-18-15-14(16(19)21)12(8-23-15)10-3-5-11(17)6-4-10/h3-6,8-9H,2,7H2,1H3