4-(4-fluorophenyl)sulfanyl-N-(furan-2-ylmethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-fluorophenyl)sulfanyl-N-(furan-2-ylmethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(4-fluorophenyl)sulfanyl-N-(2-furylmethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-[(4-fluorophenyl)thio]-N-(2-furanylmethyl)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]butanamide IUPAC Name: 4-(4-fluorophenyl)sulfanyl-N-(furan-2-ylmethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-[(4-fluorophenyl)thio]-N-(2-furfuryl)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]butyramide Formula: C23H21FN2O2S3 MolecularWeight: 472.618443

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCCSC4=CC=C(C=C4)F

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCCSC4=CC=C(C=C4)F

InChI

InChI=1S/C23H21FN2O2S3/c1-29-19-6-2-7-20-22(19)25-23(31-20)26(15-17-5-3-13-28-17)21(27)8-4-14-30-18-11-9-16(24)10-12-18/h2-3,5-7,9-13H,4,8,14-15H2,1H3