4-azanyl-1-[(2R,4S,5R)-5-[[(E)-2-bromanylethenoxy]methyl]-4-oxidanyl-thiolan-2-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(2R,4S,5R)-5-[[(E)-2-bromanylethenoxy]methyl]-4-oxidanyl-thiolan-2-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[(2R,4S,5R)-5-[[(E)-2-bromovinyloxy]methyl]-4-hydroxy-tetrahydrothiophen-2-yl]pyrimidin-2-one CAS Name: 4-amino-1-[(2R,4S,5R)-5-[[(E)-2-bromoethenoxy]methyl]-4-hydroxy-2-thiolanyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(2R,4S,5R)-5-[[(E)-2-bromoethenoxy]methyl]-4-hydroxythiolan-2-yl]pyrimidin-2-one Traditional Name: 4-amino-1-[(2R,4S,5R)-5-[[(E)-2-bromovinyloxy]methyl]-4-hydroxy-tetrahydrothiophen-2-yl]pyrimidin-2-one Formula: C11H14BrN3O3S MolecularWeight: 348.21616

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(SC1N2C=CC(=NC2=O)N)COC=CBr)O

Isomeric SMILES

C1[C@@H]([C@H](S[C@H]1N2C=CC(=NC2=O)N)CO/C=C/Br)O

InChI

InChI=1S/C11H14BrN3O3S/c12-2-4-18-6-8-7(16)5-10(19-8)15-3-1-9(13)14-11(15)17/h1-4,7-8,10,16H,5-6H2,(H2,13,14,17)/b4-2+/t7-,8+,10+/m0/s1