2-(3-fluorophenyl)-1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-fluorophenyl)-1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(3-fluorophenyl)-1-[4-(5-morpholinosulfonyl-2-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-(3-fluorophenyl)-1-[4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3-fluorophenyl)-1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(3-fluorophenyl)-1-[4-(5-morpholinosulfonyl-2-pyridyl)piperazino]ethanone Formula: C21H25FN4O4S MolecularWeight: 448.511003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)CC4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)CC4=CC(=CC=C4)F

InChI

InChI=1S/C21H25FN4O4S/c22-18-3-1-2-17(14-18)15-21(27)25-8-6-24(7-9-25)20-5-4-19(16-23-20)31(28,29)26-10-12-30-13-11-26/h1-5,14,16H,6-13,15H2