N-(3-chloranyl-2-morpholin-4-ylcarbonyl-1-benzothiophen-6-yl)-4-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-(3-chloranyl-2-morpholin-4-ylcarbonyl-1-benzothiophen-6-yl)-4-methylsulfonyl-benzenesulfonamide Openeye Name: N-[3-chloro-2-(morpholine-4-carbonyl)benzothiophen-6-yl]-4-methylsulfonyl-benzenesulfonamide CAS Name: N-[3-chloro-2-[4-morpholinyl(oxo)methyl]-1-benzothiophen-6-yl]-4-methylsulfonylbenzenesulfonamide IUPAC Name: N-[3-chloro-2-(morpholine-4-carbonyl)-1-benzothiophen-6-yl]-4-methylsulfonylbenzenesulfonamide Traditional Name: N-[3-chloro-2-(morpholine-4-carbonyl)benzothiophen-6-yl]-4-mesyl-benzenesulfonamide Formula: C20H19ClN2O6S3 MolecularWeight: 515.02266

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)C(=C(S3)C(=O)N4CCOCC4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)C(=C(S3)C(=O)N4CCOCC4)Cl

InChI

InChI=1S/C20H19ClN2O6S3/c1-31(25,26)14-3-5-15(6-4-14)32(27,28)22-13-2-7-16-17(12-13)30-19(18(16)21)20(24)23-8-10-29-11-9-23/h2-7,12,22H,8-11H2,1H3