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

Systemtic Name: (7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 5-chloranylthiophene-2-carboxylate Openeye Name: (7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 5-chlorothiophene-2-carboxylate CAS Name: 5-chloro-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 5-chlorothiophene-2-carboxylate Traditional Name: 5-chlorothiophene-2-carboxylic acid (7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C14H8BrClN2O3S MolecularWeight: 399.64692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8BrClN2O3S/c15-8-1-4-12-17-9(5-13(19)18(12)6-8)7-21-14(20)10-2-3-11(16)22-10/h1-6H,7H2