N-(1,3-benzothiazol-2-yl)-N-ethyl-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-fluoro-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-fluoro-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-fluoro-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-fluoro-3-piperidinosulfonyl-benzamide Formula: C21H22FN3O3S2 MolecularWeight: 447.546083

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H22FN3O3S2/c1-2-25(21-23-17-8-4-5-9-18(17)29-21)20(26)15-10-11-16(22)19(14-15)30(27,28)24-12-6-3-7-13-24/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3