2-[(3-azanylpyridin-2-yl)sulfanylmethyl]-7-chloranyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(3-azanylpyridin-2-yl)sulfanylmethyl]-7-chloranyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(3-amino-2-pyridyl)sulfanylmethyl]-7-chloro-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(3-amino-2-pyridinyl)thio]methyl]-7-chloro-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(3-aminopyridin-2-yl)sulfanylmethyl]-7-chloropyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(3-amino-2-pyridyl)thio]methyl]-7-chloro-pyrido[1,2-a]pyrimidin-4-one Formula: C14H11ClN4OS MolecularWeight: 318.78134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC(=O)N3C=C(C=CC3=N2)Cl)N

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC(=O)N3C=C(C=CC3=N2)Cl)N

InChI

InChI=1S/C14H11ClN4OS/c15-9-3-4-12-18-10(6-13(20)19(12)7-9)8-21-14-11(16)2-1-5-17-14/h1-7H,8,16H2