2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(4-chloro-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-[4-chloro-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-(4-chloro-3-morpholinosulfonyl-phenyl)acetamide Formula: C20H20ClN3O4S3 MolecularWeight: 498.0385

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4CS3)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4CS3)Cl

InChI

InChI=1S/C20H20ClN3O4S3/c21-16-6-5-15(11-18(16)31(26,27)24-7-9-28-10-8-24)22-19(25)13-30-20-23-17-4-2-1-3-14(17)12-29-20/h1-6,11H,7-10,12-13H2,(H,22,25)