N-[6-(2-hydroxyethyloxy)-5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)pyrimidin-4-yl]-5-propan-2-yl-pyridine-2-sulfonamide

Systemtic Name: N-[6-(2-hydroxyethyloxy)-5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)pyrimidin-4-yl]-5-propan-2-yl-pyridine-2-sulfonamide Openeye Name: N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-5-isopropyl-pyridine-2-sulfonamide CAS Name: N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(1-oxido-4-pyridin-1-iumyl)-4-pyrimidinyl]-5-propan-2-yl-2-pyridinesulfonamide IUPAC Name: N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-5-propan-2-ylpyridine-2-sulfonamide Traditional Name: N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-5-isopropyl-pyridine-2-sulfonamide Formula: C26H27N5O7S MolecularWeight: 553.58688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CN=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=CC=[N+](C=C3)[O-])OCCO)OC4=CC=CC=C4OC

Isomeric SMILES

CC(C)C1=CN=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=CC=[N+](C=C3)[O-])OCCO)OC4=CC=CC=C4OC

InChI

InChI=1S/C26H27N5O7S/c1-17(2)19-8-9-22(27-16-19)39(34,35)30-25-23(38-21-7-5-4-6-20(21)36-3)26(37-15-14-32)29-24(28-25)18-10-12-31(33)13-11-18/h4-13,16-17,32H,14-15H2,1-3H3,(H,28,29,30)