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

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(2-diethylaminoethyl)-2-methylsulfonyl-benzamide Openeye Name: N-(2-diethylaminoethyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-methylsulfonyl-benzamide CAS Name: N-(2-diethylaminoethyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide Traditional Name: N-(2-diethylaminoethyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-mesyl-benzamide Formula: C21H23F2N3O3S2 MolecularWeight: 467.552426

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C21H23F2N3O3S2/c1-4-25(5-2)10-11-26(20(27)15-8-6-7-9-18(15)31(3,28)29)21-24-19-16(23)12-14(22)13-17(19)30-21/h6-9,12-13H,4-5,10-11H2,1-3H3