2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-chloro-5-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-chloro-5-morpholinosulfonyl-phenyl)acetamide Formula: C19H18ClN3O4S3 MolecularWeight: 484.01192

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H18ClN3O4S3/c20-14-6-5-13(30(25,26)23-7-9-27-10-8-23)11-16(14)21-18(24)12-28-19-22-15-3-1-2-4-17(15)29-19/h1-6,11H,7-10,12H2,(H,21,24)