2-[[4-fluoranyl-3-[4-(1-methylpiperidin-4-yl)sulfinylpiperazin-1-yl]carbonyl-phenyl]methoxy]benzamide

Systemtic Name: 2-[[4-fluoranyl-3-[4-(1-methylpiperidin-4-yl)sulfinylpiperazin-1-yl]carbonyl-phenyl]methoxy]benzamide Openeye Name: 2-[[4-fluoro-3-[4-[(1-methyl-4-piperidyl)sulfinyl]piperazine-1-carbonyl]phenyl]methoxy]benzamide CAS Name: 2-[[4-fluoro-3-[[4-[(1-methyl-4-piperidinyl)sulfinyl]-1-piperazinyl]-oxomethyl]phenyl]methoxy]benzamide IUPAC Name: 2-[[4-fluoro-3-[4-(1-methylpiperidin-4-yl)sulfinylpiperazine-1-carbonyl]phenyl]methoxy]benzamide Traditional Name: 2-[4-fluoro-3-[4-[(1-methyl-4-piperidyl)sulfinyl]piperazine-1-carbonyl]benzyl]oxybenzamide Formula: C25H31FN4O4S MolecularWeight: 502.601443

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)S(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)COC4=CC=CC=C4C(=O)N)F

Isomeric SMILES

CN1CCC(CC1)S(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)COC4=CC=CC=C4C(=O)N)F

InChI

InChI=1S/C25H31FN4O4S/c1-28-10-8-19(9-11-28)35(33)30-14-12-29(13-15-30)25(32)21-16-18(6-7-22(21)26)17-34-23-5-3-2-4-20(23)24(27)31/h2-7,16,19H,8-15,17H2,1H3,(H2,27,31)