(4-bromanyl-2-chloranyl-phenyl) 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: (4-bromo-2-chloro-phenyl) 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionic acid (4-bromo-2-chloro-phenyl) ester Formula: C15H10BrClN2O3S MolecularWeight: 413.6735

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)OC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)OC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C15H10BrClN2O3S/c16-9-1-2-12(11(17)7-9)22-13(20)3-5-19-8-18-14-10(15(19)21)4-6-23-14/h1-2,4,6-8H,3,5H2