2-[6-(1,3-benzodioxol-5-ylsulfonylamino)-5-(2-chloranyl-5-methoxy-phenoxy)pyrimidin-4-yl]oxyethyl N-(1-methyl-2H-pyridin-5-yl)carbamate

Systemtic Name: 2-[6-(1,3-benzodioxol-5-ylsulfonylamino)-5-(2-chloranyl-5-methoxy-phenoxy)pyrimidin-4-yl]oxyethyl N-(1-methyl-2H-pyridin-5-yl)carbamate Openeye Name: 2-[6-(1,3-benzodioxol-5-ylsulfonylamino)-5-(2-chloro-5-methoxy-phenoxy)pyrimidin-4-yl]oxyethyl N-(1-methyl-2H-pyridin-5-yl)carbamate CAS Name: N-(1-methyl-2H-pyridin-5-yl)carbamic acid 2-[[6-(1,3-benzodioxol-5-ylsulfonylamino)-5-(2-chloro-5-methoxyphenoxy)-4-pyrimidinyl]oxy]ethyl ester IUPAC Name: 2-[6-(1,3-benzodioxol-5-ylsulfonylamino)-5-(2-chloro-5-methoxyphenoxy)pyrimidin-4-yl]oxyethyl N-(1-methyl-2H-pyridin-5-yl)carbamate Traditional Name: N-(1-methyl-2H-pyridin-5-yl)carbamic acid 2-[6-(1,3-benzodioxol-5-ylsulfonylamino)-5-(2-chloro-5-methoxy-phenoxy)pyrimidin-4-yl]oxyethyl ester Formula: C27H26ClN5O9S MolecularWeight: 632.04144

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC=CC(=C1)NC(=O)OCCOC2=NC=NC(=C2OC3=C(C=CC(=C3)OC)Cl)NS(=O)(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1CC=CC(=C1)NC(=O)OCCOC2=NC=NC(=C2OC3=C(C=CC(=C3)OC)Cl)NS(=O)(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H26ClN5O9S/c1-33-9-3-4-17(14-33)31-27(34)39-11-10-38-26-24(42-22-12-18(37-2)5-7-20(22)28)25(29-15-30-26)32-43(35,36)19-6-8-21-23(13-19)41-16-40-21/h3-8,12-15H,9-11,16H2,1-2H3,(H,31,34)(H,29,30,32)