(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: (7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: (7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid (7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid (7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C14H7Br3N2O3S MolecularWeight: 522.99398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CC(=O)N2C=C1Br)COC(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

C1=CC2=NC(=CC(=O)N2C=C1Br)COC(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C14H7Br3N2O3S/c15-7-1-2-11-18-8(3-12(20)19(11)5-7)6-22-14(21)10-4-9(16)13(17)23-10/h1-5H,6H2