4-[[4-(4-chloranylphenoxy)-5-cyano-pyrimidin-2-yl]amino]-N-(2-methoxyethyl)benzenesulfonamide

Systemtic Name: 4-[[4-(4-chloranylphenoxy)-5-cyano-pyrimidin-2-yl]amino]-N-(2-methoxyethyl)benzenesulfonamide Openeye Name: 4-[[4-(4-chlorophenoxy)-5-cyano-pyrimidin-2-yl]amino]-N-(2-methoxyethyl)benzenesulfonamide CAS Name: 4-[[4-(4-chlorophenoxy)-5-cyano-2-pyrimidinyl]amino]-N-(2-methoxyethyl)benzenesulfonamide IUPAC Name: 4-[[4-(4-chlorophenoxy)-5-cyanopyrimidin-2-yl]amino]-N-(2-methoxyethyl)benzenesulfonamide Traditional Name: 4-[[4-(4-chlorophenoxy)-5-cyano-pyrimidin-2-yl]amino]-N-(2-methoxyethyl)benzenesulfonamide Formula: C20H18ClN5O4S MolecularWeight: 459.90602

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Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)OC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

COCCNS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)OC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C20H18ClN5O4S/c1-29-11-10-24-31(27,28)18-8-4-16(5-9-18)25-20-23-13-14(12-22)19(26-20)30-17-6-2-15(21)3-7-17/h2-9,13,24H,10-11H2,1H3,(H,23,25,26)