N-[5-(2-chloranyl-5-methoxy-phenoxy)-6-(2-hydroxyethyloxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)pyrimidin-4-yl]-3-propan-2-yl-pyridine-2-sulfonamide

Systemtic Name: N-[5-(2-chloranyl-5-methoxy-phenoxy)-6-(2-hydroxyethyloxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)pyrimidin-4-yl]-3-propan-2-yl-pyridine-2-sulfonamide Openeye Name: N-[5-(2-chloro-5-methoxy-phenoxy)-6-(2-hydroxyethoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-3-isopropyl-pyridine-2-sulfonamide CAS Name: N-[5-(2-chloro-5-methoxyphenoxy)-6-(2-hydroxyethoxy)-2-(1-oxido-4-pyridin-1-iumyl)-4-pyrimidinyl]-3-propan-2-yl-2-pyridinesulfonamide IUPAC Name: N-[5-(2-chloro-5-methoxyphenoxy)-6-(2-hydroxyethoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-3-propan-2-ylpyridine-2-sulfonamide Traditional Name: N-[5-(2-chloro-5-methoxy-phenoxy)-6-(2-hydroxyethoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-3-isopropyl-pyridine-2-sulfonamide Formula: C26H26ClN5O7S MolecularWeight: 588.03194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=CC=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=CC=[N+](C=C3)[O-])OCCO)OC4=C(C=CC(=C4)OC)Cl

Isomeric SMILES

CC(C)C1=C(N=CC=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=CC=[N+](C=C3)[O-])OCCO)OC4=C(C=CC(=C4)OC)Cl

InChI

InChI=1S/C26H26ClN5O7S/c1-16(2)19-5-4-10-28-26(19)40(35,36)31-24-22(39-21-15-18(37-3)6-7-20(21)27)25(38-14-13-33)30-23(29-24)17-8-11-32(34)12-9-17/h4-12,15-16,33H,13-14H2,1-3H3,(H,29,30,31)