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

Systemtic Name: 2-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-cyclohexyl-ethanamide Openeye Name: 2-[(7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[(7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-N-cyclohexylacetamide IUPAC Name: 2-[(7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-cyclohexylacetamide Traditional Name: 2-[(7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-N-cyclohexyl-acetamide Formula: C17H20BrN3O2S MolecularWeight: 410.3286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSCC2=CC(=O)N3C=C(C=CC3=N2)Br

Isomeric SMILES

C1CCC(CC1)NC(=O)CSCC2=CC(=O)N3C=C(C=CC3=N2)Br

InChI

InChI=1S/C17H20BrN3O2S/c18-12-6-7-15-19-14(8-17(23)21(15)9-12)10-24-11-16(22)20-13-4-2-1-3-5-13/h6-9,13H,1-5,10-11H2,(H,20,22)