6-azanyl-2-[(E)-3-chloranylprop-2-enyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[(E)-3-chloranylprop-2-enyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[(E)-3-chloroallyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[(E)-3-chloroprop-2-enyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[(E)-3-chloroprop-2-enyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[(E)-3-chloroallyl]thio]-1H-pyrimidin-4-one Formula: C7H8ClN3OS MolecularWeight: 217.67592

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=NC1=O)SCC=CCl)N

Isomeric SMILES

C1=C(NC(=NC1=O)SC/C=C/Cl)N

InChI

InChI=1S/C7H8ClN3OS/c8-2-1-3-13-7-10-5(9)4-6(12)11-7/h1-2,4H,3H2,(H3,9,10,11,12)/b2-1+