N-[6-chloranyl-5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)pyrimidin-4-yl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[6-chloranyl-5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)pyrimidin-4-yl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[6-chloro-5-(2-methoxyphenoxy)-2-(1-oxido-4-pyridin-1-iumyl)-4-pyrimidinyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)pyrimidin-4-yl]-3,4-dimethoxy-benzenesulfonamide Formula: C24H21ClN4O7S MolecularWeight: 544.96414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=CC=[N+](C=C3)[O-])Cl)OC4=CC=CC=C4OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=CC=[N+](C=C3)[O-])Cl)OC4=CC=CC=C4OC)OC

InChI

InChI=1S/C24H21ClN4O7S/c1-33-17-6-4-5-7-19(17)36-21-22(25)26-23(15-10-12-29(30)13-11-15)27-24(21)28-37(31,32)16-8-9-18(34-2)20(14-16)35-3/h4-14H,1-3H3,(H,26,27,28)