3-[5-(3-fluoranyl-4-methoxy-phenyl)-6-(4-sulfamoylphenyl)pyridin-3-yl]propyl N-methyl-N-oxidanyl-carbamodithioate

Systemtic Name: 3-[5-(3-fluoranyl-4-methoxy-phenyl)-6-(4-sulfamoylphenyl)pyridin-3-yl]propyl N-methyl-N-oxidanyl-carbamodithioate Openeye Name: 3-[5-(3-fluoro-4-methoxy-phenyl)-6-(4-sulfamoylphenyl)-3-pyridyl]propyl N-hydroxy-N-methyl-carbamodithioate CAS Name: N-hydroxy-N-methylcarbamodithioic acid 3-[5-(3-fluoro-4-methoxyphenyl)-6-(4-sulfamoylphenyl)-3-pyridinyl]propyl ester IUPAC Name: 3-[5-(3-fluoro-4-methoxyphenyl)-6-(4-sulfamoylphenyl)pyridin-3-yl]propyl N-hydroxy-N-methylcarbamodithioate Traditional Name: N-hydroxy-N-methyl-carbamodithioic acid 3-[5-(3-fluoro-4-methoxy-phenyl)-6-(4-sulfamoylphenyl)-3-pyridyl]propyl ester Formula: C23H24FN3O4S3 MolecularWeight: 521.647763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)SCCCC1=CN=C(C(=C1)C2=CC(=C(C=C2)OC)F)C3=CC=C(C=C3)S(=O)(=O)N)O

Isomeric SMILES

CN(C(=S)SCCCC1=CN=C(C(=C1)C2=CC(=C(C=C2)OC)F)C3=CC=C(C=C3)S(=O)(=O)N)O

InChI

InChI=1S/C23H24FN3O4S3/c1-27(28)23(32)33-11-3-4-15-12-19(17-7-10-21(31-2)20(24)13-17)22(26-14-15)16-5-8-18(9-6-16)34(25,29)30/h5-10,12-14,28H,3-4,11H2,1-2H3,(H2,25,29,30)