2-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-butyl-ethanamide

Systemtic Name: 2-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-butyl-ethanamide Openeye Name: 2-[(7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-butyl-acetamide CAS Name: 2-[(7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-N-butylacetamide IUPAC Name: 2-[(7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-butylacetamide Traditional Name: 2-[(7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-N-butyl-acetamide Formula: C15H18BrN3O2S MolecularWeight: 384.29132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSCC1=CC(=O)N2C=C(C=CC2=N1)Br

Isomeric SMILES

CCCCNC(=O)CSCC1=CC(=O)N2C=C(C=CC2=N1)Br

InChI

InChI=1S/C15H18BrN3O2S/c1-2-3-6-17-14(20)10-22-9-12-7-15(21)19-8-11(16)4-5-13(19)18-12/h4-5,7-8H,2-3,6,9-10H2,1H3,(H,17,20)