N-[6-chloranyl-5-[(2,6-dimethoxyphenyl)methyl]pyrimidin-4-yl]-4-ethenyl-benzenesulfonamide

Systemtic Name: N-[6-chloranyl-5-[(2,6-dimethoxyphenyl)methyl]pyrimidin-4-yl]-4-ethenyl-benzenesulfonamide Openeye Name: N-[6-chloro-5-[(2,6-dimethoxyphenyl)methyl]pyrimidin-4-yl]-4-vinyl-benzenesulfonamide CAS Name: N-[6-chloro-5-[(2,6-dimethoxyphenyl)methyl]-4-pyrimidinyl]-4-ethenylbenzenesulfonamide IUPAC Name: N-[6-chloro-5-[(2,6-dimethoxyphenyl)methyl]pyrimidin-4-yl]-4-ethenylbenzenesulfonamide Traditional Name: N-[6-chloro-5-(2,6-dimethoxybenzyl)pyrimidin-4-yl]-4-vinyl-benzenesulfonamide Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)CC2=C(N=CN=C2Cl)NS(=O)(=O)C3=CC=C(C=C3)C=C

Isomeric SMILES

COC1=C(C(=CC=C1)OC)CC2=C(N=CN=C2Cl)NS(=O)(=O)C3=CC=C(C=C3)C=C

InChI

InChI=1S/C21H20ClN3O4S/c1-4-14-8-10-15(11-9-14)30(26,27)25-21-17(20(22)23-13-24-21)12-16-18(28-2)6-5-7-19(16)29-3/h4-11,13H,1,12H2,2-3H3,(H,23,24,25)