4-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-[2-(4-sulfamoylphenyl)ethyl]butyramide Formula: C19H21N3O3S3 MolecularWeight: 435.58334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCCCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCCCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H21N3O3S3/c20-28(24,25)15-9-7-14(8-10-15)11-12-21-18(23)6-3-13-26-19-22-16-4-1-2-5-17(16)27-19/h1-2,4-5,7-10H,3,6,11-13H2,(H,21,23)(H2,20,24,25)