2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromanyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromanyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-7-bromo-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromopyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one Formula: C12H11BrN6OS MolecularWeight: 367.22434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC2=CC(=O)N3C=C(C=CC3=N2)Br

Isomeric SMILES

CC1=NN=C(N1N)SCC2=CC(=O)N3C=C(C=CC3=N2)Br

InChI

InChI=1S/C12H11BrN6OS/c1-7-16-17-12(19(7)14)21-6-9-4-11(20)18-5-8(13)2-3-10(18)15-9/h2-5H,6,14H2,1H3