N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-yl]ethanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-yl]ethanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(5-fluorobenzotriazol-1-yl)-1-piperidyl]acetamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(5-fluoro-1-benzotriazolyl)-1-piperidinyl]acetamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(5-fluorobenzotriazol-1-yl)piperidin-1-yl]acetamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(5-fluorobenzotriazol-1-yl)piperidino]acetamide Formula: C22H23FN6O2S MolecularWeight: 454.520423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3CCC(CC3)N4C5=C(C=C(C=C5)F)N=N4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3CCC(CC3)N4C5=C(C=C(C=C5)F)N=N4

InChI

InChI=1S/C22H23FN6O2S/c1-2-31-16-4-5-17-20(12-16)32-22(24-17)25-21(30)13-28-9-7-15(8-10-28)29-19-6-3-14(23)11-18(19)26-27-29/h3-6,11-12,15H,2,7-10,13H2,1H3,(H,24,25,30)