N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfonyl-ethanamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfonyl-ethanamide Openeye Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfonyl-acetamide CAS Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfonylacetamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfonylacetamide Traditional Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfonyl-acetamide Formula: C21H24FN3O3S2 MolecularWeight: 449.561963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N(CCN(C)C)C(=O)CS(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N(CCN(C)C)C(=O)CS(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H24FN3O3S2/c1-14-11-15(2)20-18(12-14)23-21(29-20)25(10-9-24(3)4)19(26)13-30(27,28)17-7-5-16(22)6-8-17/h5-8,11-12H,9-10,13H2,1-4H3