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

Systemtic Name: (2S)-N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Openeye Name: (2S)-N-[(4-methoxyphenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide CAS Name: (2S)-N-[(4-methoxyphenyl)methyl]-2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazine-4-carbothioamide IUPAC Name: (2S)-N-[(4-methoxyphenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Traditional Name: (2S)-N-p-anisyl-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)N2CC(OC3=CC=CC=C32)C(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)N2C[C@H](OC3=CC=CC=C32)C(=O)N4CCCCC4

InChI

InChI=1S/C23H27N3O3S/c1-28-18-11-9-17(10-12-18)15-24-23(30)26-16-21(22(27)25-13-5-2-6-14-25)29-20-8-4-3-7-19(20)26/h3-4,7-12,21H,2,5-6,13-16H2,1H3,(H,24,30)/t21-/m0/s1