4-(4-chlorophenyl)sulfonyl-N-(furan-2-ylmethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-(furan-2-ylmethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(4-chlorophenyl)sulfonyl-N-(2-furylmethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-(2-furanylmethyl)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]butanamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-(furan-2-ylmethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-(4-chlorophenyl)sulfonyl-N-(2-furfuryl)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]butyramide Formula: C23H21ClN2O4S3 MolecularWeight: 521.07184

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H21ClN2O4S3/c1-31-19-6-2-7-20-22(19)25-23(32-20)26(15-17-5-3-13-30-17)21(27)8-4-14-33(28,29)18-11-9-16(24)10-12-18/h2-3,5-7,9-13H,4,8,14-15H2,1H3