3-fluoranyl-N-[6-[4-(3-methyl-2-oxidanyl-butyl)piperazin-1-yl]pyridin-3-yl]benzamide

Systemtic Name: 3-fluoranyl-N-[6-[4-(3-methyl-2-oxidanyl-butyl)piperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: 3-fluoro-N-[6-[4-(2-hydroxy-3-methyl-butyl)piperazin-1-yl]-3-pyridyl]benzamide CAS Name: 3-fluoro-N-[6-[4-(2-hydroxy-3-methylbutyl)-1-piperazinyl]-3-pyridinyl]benzamide IUPAC Name: 3-fluoro-N-[6-[4-(2-hydroxy-3-methylbutyl)piperazin-1-yl]pyridin-3-yl]benzamide Traditional Name: 3-fluoro-N-[6-[4-(2-hydroxy-3-methyl-butyl)piperazino]-3-pyridyl]benzamide Formula: C21H27FN4O2 MolecularWeight: 386.463083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=CC=C3)F)O

Isomeric SMILES

CC(C)C(CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=CC=C3)F)O

InChI

InChI=1S/C21H27FN4O2/c1-15(2)19(27)14-25-8-10-26(11-9-25)20-7-6-18(13-23-20)24-21(28)16-4-3-5-17(22)12-16/h3-7,12-13,15,19,27H,8-11,14H2,1-2H3,(H,24,28)