4-(4-fluorophenyl)sulfonyl-N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide

Systemtic Name: 4-(4-fluorophenyl)sulfonyl-N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide Openeye Name: 4-(4-fluorophenyl)sulfonyl-N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide CAS Name: 4-(4-fluorophenyl)sulfonyl-N-[6-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]butanamide IUPAC Name: 4-(4-fluorophenyl)sulfonyl-N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide Traditional Name: 4-(4-fluorophenyl)sulfonyl-N-[6-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]butyramide Formula: C21H23FN2O4S3 MolecularWeight: 482.611723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F)S2)CCSC

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F)S2)CCSC

InChI

InChI=1S/C21H23FN2O4S3/c1-28-16-7-10-18-19(14-16)30-21(24(18)11-12-29-2)23-20(25)4-3-13-31(26,27)17-8-5-15(22)6-9-17/h5-10,14H,3-4,11-13H2,1-2H3