4-azanyl-1-[[2-(chloromethyl)phenyl]methyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[[2-(chloromethyl)phenyl]methyl]pyrimidin-2-one Openeye Name: 4-amino-1-[[2-(chloromethyl)phenyl]methyl]pyrimidin-2-one CAS Name: 4-amino-1-[[2-(chloromethyl)phenyl]methyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[[2-(chloromethyl)phenyl]methyl]pyrimidin-2-one Traditional Name: 4-amino-1-[2-(chloromethyl)benzyl]pyrimidin-2-one Formula: C12H12ClN3O MolecularWeight: 249.69618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC(=NC2=O)N)CCl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC(=NC2=O)N)CCl

InChI

InChI=1S/C12H12ClN3O/c13-7-9-3-1-2-4-10(9)8-16-6-5-11(14)15-12(16)17/h1-6H,7-8H2,(H2,14,15,17)