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

Systemtic Name: 4-(4-fluorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]butanamide Openeye Name: 4-(4-fluorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]butanamide CAS Name: 4-(4-fluorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]butanamide IUPAC Name: 4-(4-fluorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]butanamide Traditional Name: 4-(4-fluorophenyl)sulfonyl-N-[6-mesyl-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]butyramide Formula: C21H23FN2O6S3 MolecularWeight: 514.610523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23FN2O6S3/c1-30-12-11-24-18-10-9-17(32(2,26)27)14-19(18)31-21(24)23-20(25)4-3-13-33(28,29)16-7-5-15(22)6-8-16/h5-10,14H,3-4,11-13H2,1-2H3