N-[4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)cyclohexyl]-5-fluoranyl-2-(3-methylsulfanylphenoxy)pyridine-3-carboxamide

Systemtic Name: N-[4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)cyclohexyl]-5-fluoranyl-2-(3-methylsulfanylphenoxy)pyridine-3-carboxamide Openeye Name: N-[4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)cyclohexyl]-5-fluoro-2-(3-methylsulfanylphenoxy)pyridine-3-carboxamide CAS Name: N-[4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)cyclohexyl]-5-fluoro-2-[3-(methylthio)phenoxy]-3-pyridinecarboxamide IUPAC Name: N-[4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)cyclohexyl]-5-fluoro-2-(3-methylsulfanylphenoxy)pyridine-3-carboxamide Traditional Name: 5-fluoro-2-[3-(methylthio)phenoxy]-N-[4-(piazthiol-4-ylsulfonylamino)cyclohexyl]nicotinamide Formula: C25H24FN5O4S3 MolecularWeight: 573.682563

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)OC2=NC=C(C=C2C(=O)NC3CCC(CC3)NS(=O)(=O)C4=CC=CC5=NSN=C54)F

Isomeric SMILES

CSC1=CC=CC(=C1)OC2=NC=C(C=C2C(=O)NC3CCC(CC3)NS(=O)(=O)C4=CC=CC5=NSN=C54)F

InChI

InChI=1S/C25H24FN5O4S3/c1-36-19-5-2-4-18(13-19)35-25-20(12-15(26)14-27-25)24(32)28-16-8-10-17(11-9-16)31-38(33,34)22-7-3-6-21-23(22)30-37-29-21/h2-7,12-14,16-17,31H,8-11H2,1H3,(H,28,32)