2-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methylamino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methylamino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[(7-bromo-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-amino]-N-[2-(methylthio)phenyl]acetamide Formula: C19H20BrN4O2S+ MolecularWeight: 448.3567

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=O)[N+]2=C(N1)C=CC(=C2)Br)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CN(CC1=CC(=O)[N+]2=C(N1)C=CC(=C2)Br)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C19H19BrN4O2S/c1-23(12-18(25)22-15-5-3-4-6-16(15)27-2)11-14-9-19(26)24-10-13(20)7-8-17(24)21-14/h3-10H,11-12H2,1-2H3,(H,22,25)/p+1