2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-7-bromanyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-7-bromanyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]methyl]-7-bromo-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-7-bromopyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidino]methyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one Formula: C20H17BrN4OS MolecularWeight: 441.34418

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC2=CC(=O)N3C=C(C=CC3=N2)Br)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(N(C1)CC2=CC(=O)N3C=C(C=CC3=N2)Br)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H17BrN4OS/c21-13-7-8-18-22-14(10-19(26)25(18)11-13)12-24-9-3-5-16(24)20-23-15-4-1-2-6-17(15)27-20/h1-2,4,6-8,10-11,16H,3,5,9,12H2