(2S)-N-[(4-fluorophenyl)methyl]-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazine-4-carbothioamide

Systemtic Name: (2S)-N-[(4-fluorophenyl)methyl]-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Openeye Name: (2S)-N-[(4-fluorophenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide CAS Name: (2S)-N-[(4-fluorophenyl)methyl]-2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazine-4-carbothioamide IUPAC Name: (2S)-N-[(4-fluorophenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Traditional Name: (2S)-N-(4-fluorobenzyl)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Formula: C22H24FN3O2S MolecularWeight: 413.508263

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)C(=S)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H]2CN(C3=CC=CC=C3O2)C(=S)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O2S/c23-17-10-8-16(9-11-17)14-24-22(29)26-15-20(21(27)25-12-4-1-5-13-25)28-19-7-3-2-6-18(19)26/h2-3,6-11,20H,1,4-5,12-15H2,(H,24,29)/t20-/m0/s1