4-azanyl-1-[(E)-2-bromanyl-4-oxidanyl-3-phenyl-but-2-enyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(E)-2-bromanyl-4-oxidanyl-3-phenyl-but-2-enyl]pyrimidin-2-one Openeye Name: 4-amino-1-[(E)-2-bromo-4-hydroxy-3-phenyl-but-2-enyl]pyrimidin-2-one CAS Name: 4-amino-1-[(E)-2-bromo-4-hydroxy-3-phenylbut-2-enyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(E)-2-bromo-4-hydroxy-3-phenylbut-2-enyl]pyrimidin-2-one Traditional Name: 4-amino-1-[(E)-2-bromo-4-hydroxy-3-phenyl-but-2-enyl]pyrimidin-2-one Formula: C14H14BrN3O2 MolecularWeight: 336.18386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(CN2C=CC(=NC2=O)N)Br)CO

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(/CN2C=CC(=NC2=O)N)\Br)/CO

InChI

InChI=1S/C14H14BrN3O2/c15-12(8-18-7-6-13(16)17-14(18)20)11(9-19)10-4-2-1-3-5-10/h1-7,19H,8-9H2,(H2,16,17,20)/b12-11-