1-[(3-bromophenyl)methyl]-4-(3-oxidanylpropylamino)pyrimidin-2-one

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-(3-oxidanylpropylamino)pyrimidin-2-one Openeye Name: 1-[(3-bromophenyl)methyl]-4-(3-hydroxypropylamino)pyrimidin-2-one CAS Name: 1-[(3-bromophenyl)methyl]-4-(3-hydroxypropylamino)-2-pyrimidinone IUPAC Name: 1-[(3-bromophenyl)methyl]-4-(3-hydroxypropylamino)pyrimidin-2-one Traditional Name: 1-(3-bromobenzyl)-4-(3-hydroxypropylamino)pyrimidin-2-one Formula: C14H16BrN3O2 MolecularWeight: 338.19974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CN2C=CC(=NC2=O)NCCCO

Isomeric SMILES

C1=CC(=CC(=C1)Br)CN2C=CC(=NC2=O)NCCCO

InChI

InChI=1S/C14H16BrN3O2/c15-12-4-1-3-11(9-12)10-18-7-5-13(17-14(18)20)16-6-2-8-19/h1,3-5,7,9,19H,2,6,8,10H2,(H,16,17,20)