4-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(diethylsulfamoyl)-2-propan-2-yloxy-phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(diethylsulfamoyl)-2-propan-2-yloxy-phenyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(diethylsulfamoyl)-2-isopropoxy-phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-[5-(diethylsulfamoyl)-2-isopropoxy-phenyl]butyramide Formula: C24H31N3O4S3 MolecularWeight: 521.71564

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC(C)C)NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC(C)C)NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C24H31N3O4S3/c1-5-27(6-2)34(29,30)18-13-14-21(31-17(3)4)20(16-18)25-23(28)12-9-15-32-24-26-19-10-7-8-11-22(19)33-24/h7-8,10-11,13-14,16-17H,5-6,9,12,15H2,1-4H3,(H,25,28)