4-(4-fluorophenyl)sulfanyl-N-[5-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide

Systemtic Name: 4-(4-fluorophenyl)sulfanyl-N-[5-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide Openeye Name: 4-(4-fluorophenyl)sulfanyl-N-[5-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide CAS Name: 4-[(4-fluorophenyl)thio]-N-[5-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]butanamide IUPAC Name: 4-(4-fluorophenyl)sulfanyl-N-[5-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide Traditional Name: 4-[(4-fluorophenyl)thio]-N-[5-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]butyramide Formula: C21H23FN2O2S3 MolecularWeight: 450.612923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=NC(=O)CCCSC3=CC=C(C=C3)F)N2CCSC

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=NC(=O)CCCSC3=CC=C(C=C3)F)N2CCSC

InChI

InChI=1S/C21H23FN2O2S3/c1-26-16-7-10-19-18(14-16)24(11-13-27-2)21(29-19)23-20(25)4-3-12-28-17-8-5-15(22)6-9-17/h5-10,14H,3-4,11-13H2,1-2H3