4-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(2-furylmethylsulfamoyl)phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[4-(2-furanylmethylsulfamoyl)phenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-[4-(2-furfurylsulfamoyl)phenyl]butyramide Formula: C22H21N3O4S3 MolecularWeight: 487.61484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H21N3O4S3/c26-21(8-4-14-30-22-25-19-6-1-2-7-20(19)31-22)24-16-9-11-18(12-10-16)32(27,28)23-15-17-5-3-13-29-17/h1-3,5-7,9-13,23H,4,8,14-15H2,(H,24,26)