(E)-4-[(5-chloranyl-2H-pyrimidin-1-yl)sulfonyl]but-3-en-2-one

Systemtic Name: (E)-4-[(5-chloranyl-2H-pyrimidin-1-yl)sulfonyl]but-3-en-2-one Openeye Name: (E)-4-[(5-chloro-2H-pyrimidin-1-yl)sulfonyl]but-3-en-2-one CAS Name: (E)-4-[(5-chloro-2H-pyrimidin-1-yl)sulfonyl]-3-buten-2-one IUPAC Name: (E)-4-[(5-chloro-2H-pyrimidin-1-yl)sulfonyl]but-3-en-2-one Traditional Name: (E)-4-[(5-chloro-2H-pyrimidin-1-yl)sulfonyl]but-3-en-2-one Formula: C8H9ClN2O3S MolecularWeight: 248.68666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CS(=O)(=O)N1CN=CC(=C1)Cl

Isomeric SMILES

CC(=O)/C=C/S(=O)(=O)N1CN=CC(=C1)Cl

InChI

InChI=1S/C8H9ClN2O3S/c1-7(12)2-3-15(13,14)11-5-8(9)4-10-6-11/h2-5H,6H2,1H3/b3-2+