3-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-morpholin-4-ylphenyl)propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-morpholin-4-ylphenyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-morpholinophenyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-[4-(4-morpholinyl)phenyl]-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-morpholin-4-ylphenyl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(4-morpholinophenyl)propane-1-sulfonamide Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NS(=O)(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NS(=O)(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H23N3O3S3/c24-29(25,15-3-14-27-20-21-18-4-1-2-5-19(18)28-20)22-16-6-8-17(9-7-16)23-10-12-26-13-11-23/h1-2,4-9,22H,3,10-15H2