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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)SC)SC1=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)SC)SC1=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O4S3/c1-28-12-11-24-18-10-7-16(29-2)14-19(18)30-21(24)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