N-[6-chloranyl-5-[(2-methoxyphenyl)methyl]pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-[6-chloranyl-5-[(2-methoxyphenyl)methyl]pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-[6-chloro-5-[(2-methoxyphenyl)methyl]pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide CAS Name: N-[6-chloro-5-[(2-methoxyphenyl)methyl]-4-pyrimidinyl]-4-(methylthio)benzenesulfonamide IUPAC Name: N-[6-chloro-5-[(2-methoxyphenyl)methyl]pyrimidin-4-yl]-4-methylsulfanylbenzenesulfonamide Traditional Name: N-(6-chloro-5-o-anisyl-pyrimidin-4-yl)-4-(methylthio)benzenesulfonamide Formula: C19H18ClN3O3S2 MolecularWeight: 435.94752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC2=C(N=CN=C2Cl)NS(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

COC1=CC=CC=C1CC2=C(N=CN=C2Cl)NS(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C19H18ClN3O3S2/c1-26-17-6-4-3-5-13(17)11-16-18(20)21-12-22-19(16)23-28(24,25)15-9-7-14(27-2)8-10-15/h3-10,12H,11H2,1-2H3,(H,21,22,23)