N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(4-fluorophenyl)sulfonylpiperazino]acetamide Formula: C21H23FN4O4S2 MolecularWeight: 478.560123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H23FN4O4S2/c1-2-30-16-5-8-18-19(13-16)31-21(23-18)24-20(27)14-25-9-11-26(12-10-25)32(28,29)17-6-3-15(22)4-7-17/h3-8,13H,2,9-12,14H2,1H3,(H,23,24,27)