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

Systemtic Name: 3-[6-(4-fluorophenyl)-5-(4-sulfamoylphenyl)pyridin-3-yl]propyl N-methyl-N-oxidanyl-carbamodithioate Openeye Name: 3-[6-(4-fluorophenyl)-5-(4-sulfamoylphenyl)-3-pyridyl]propyl N-hydroxy-N-methyl-carbamodithioate CAS Name: N-hydroxy-N-methylcarbamodithioic acid 3-[6-(4-fluorophenyl)-5-(4-sulfamoylphenyl)-3-pyridinyl]propyl ester IUPAC Name: 3-[6-(4-fluorophenyl)-5-(4-sulfamoylphenyl)pyridin-3-yl]propyl N-hydroxy-N-methylcarbamodithioate Traditional Name: N-hydroxy-N-methyl-carbamodithioic acid 3-[6-(4-fluorophenyl)-5-(4-sulfamoylphenyl)-3-pyridyl]propyl ester Formula: C22H22FN3O3S3 MolecularWeight: 491.621783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22FN3O3S3/c1-26(27)22(30)31-12-2-3-15-13-20(16-6-10-19(11-7-16)32(24,28)29)21(25-14-15)17-4-8-18(23)9-5-17/h4-11,13-14,27H,2-3,12H2,1H3,(H2,24,28,29)