N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-fluoranyl-benzamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-fluoranyl-benzamide Openeye Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-fluoro-benzamide CAS Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-fluorobenzamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-fluorobenzamide Traditional Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-fluoro-benzamide Formula: C22H26FN3O2S MolecularWeight: 415.524143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FN3O2S/c1-4-25(5-2)14-15-26(21(27)16-10-12-17(23)13-11-16)22-24-20-18(28-6-3)8-7-9-19(20)29-22/h7-13H,4-6,14-15H2,1-3H3