(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[(3-bromophenyl)carbonylamino]ethanoate

Systemtic Name: (5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[(3-bromophenyl)carbonylamino]ethanoate Openeye Name: (5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[(3-bromobenzoyl)amino]acetate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]acetic acid (5-oxo-7-thiazolo[3,2-a]pyrimidinyl)methyl ester IUPAC Name: (5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[(3-bromobenzoyl)amino]acetate Traditional Name: 2-[(3-bromobenzoyl)amino]acetic acid (5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl ester Formula: C16H12BrN3O4S MolecularWeight: 422.25318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NCC(=O)OCC2=CC(=O)N3C=CSC3=N2

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NCC(=O)OCC2=CC(=O)N3C=CSC3=N2

InChI

InChI=1S/C16H12BrN3O4S/c17-11-3-1-2-10(6-11)15(23)18-8-14(22)24-9-12-7-13(21)20-4-5-25-16(20)19-12/h1-7H,8-9H2,(H,18,23)