(1S,2R)-2-[(4-fluorophenyl)methoxyamino]-N-methyl-1-pyridin-3-yl-cyclohexane-1-carbothioamide

Systemtic Name: (1S,2R)-2-[(4-fluorophenyl)methoxyamino]-N-methyl-1-pyridin-3-yl-cyclohexane-1-carbothioamide Openeye Name: (1S,2R)-2-[(4-fluorophenyl)methoxyamino]-N-methyl-1-(3-pyridyl)cyclohexanecarbothioamide CAS Name: (1S,2R)-2-[(4-fluorophenyl)methoxyamino]-N-methyl-1-(3-pyridinyl)-1-cyclohexanecarbothioamide IUPAC Name: (1S,2R)-2-[(4-fluorophenyl)methoxyamino]-N-methyl-1-pyridin-3-ylcyclohexane-1-carbothioamide Traditional Name: (1S,2R)-2-[(4-fluorobenzyl)oxyamino]-N-methyl-1-(3-pyridyl)cyclohexanecarbothioamide Formula: C20H24FN3OS MolecularWeight: 373.487463

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1(CCCCC1NOCC2=CC=C(C=C2)F)C3=CN=CC=C3

Isomeric SMILES

CNC(=S)[C@@]1(CCCC[C@H]1NOCC2=CC=C(C=C2)F)C3=CN=CC=C3

InChI

InChI=1S/C20H24FN3OS/c1-22-19(26)20(16-5-4-12-23-13-16)11-3-2-6-18(20)24-25-14-15-7-9-17(21)10-8-15/h4-5,7-10,12-13,18,24H,2-3,6,11,14H2,1H3,(H,22,26)/t18-,20+/m1/s1