N-[4,6-bis(fluoranyl)-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide

Systemtic Name: N-[4,6-bis(fluoranyl)-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide Openeye Name: N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide CAS Name: N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-methylsulfonylbenzamide IUPAC Name: N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-methylsulfonylbenzamide Traditional Name: N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-mesyl-benzamide Formula: C18H16F2N2O4S2 MolecularWeight: 426.457446

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=CC=C3S(=O)(=O)C)F)F

Isomeric SMILES

COCCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=CC=C3S(=O)(=O)C)F)F

InChI

InChI=1S/C18H16F2N2O4S2/c1-26-8-7-22-16-13(20)9-11(19)10-14(16)27-18(22)21-17(23)12-5-3-4-6-15(12)28(2,24)25/h3-6,9-10H,7-8H2,1-2H3