(6E)-6-(6-azanyl-3-methylsulfonyl-5-oxidanyl-1H-pyridin-2-ylidene)-4-chloranyl-3-methylsulfonyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(6-azanyl-3-methylsulfonyl-5-oxidanyl-1H-pyridin-2-ylidene)-4-chloranyl-3-methylsulfonyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-(6-amino-5-hydroxy-3-methylsulfonyl-1H-pyridin-2-ylidene)-4-chloro-3-methylsulfonyl-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-(6-amino-5-hydroxy-3-methylsulfonyl-1H-pyridin-2-ylidene)-4-chloro-3-methylsulfonyl-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(6-amino-5-hydroxy-3-methylsulfonyl-1H-pyridin-2-ylidene)-4-chloro-3-methylsulfonylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-(6-amino-5-hydroxy-3-mesyl-1H-pyridin-2-ylidene)-4-chloro-3-mesyl-cyclohexa-2,4-dien-1-one Formula: C13H13ClN2O6S2 MolecularWeight: 392.83512

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(NC1=C2C=C(C(=CC2=O)S(=O)(=O)C)Cl)N)O

Isomeric SMILES

CS(=O)(=O)C\1=CC(=C(N/C1=C/2\C=C(C(=CC2=O)S(=O)(=O)C)Cl)N)O

InChI

InChI=1S/C13H13ClN2O6S2/c1-23(19,20)10-4-8(17)6(3-7(10)14)12-11(24(2,21)22)5-9(18)13(15)16-12/h3-5,16,18H,15H2,1-2H3/b12-6+