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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methoxy-5-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-methoxy-5-morpholinosulfonyl-phenyl)acetamide Formula: C20H21N3O5S3 MolecularWeight: 479.59284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3O5S3/c1-27-17-7-6-14(31(25,26)23-8-10-28-11-9-23)12-16(17)21-19(24)13-29-20-22-15-4-2-3-5-18(15)30-20/h2-7,12H,8-11,13H2,1H3,(H,21,24)