(3R,5R)-N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-piperidine-1-carbothioamide

Systemtic Name: (3R,5R)-N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-piperidine-1-carbothioamide Openeye Name: (3R,5R)-N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-piperidine-1-carbothioamide CAS Name: (3R,5R)-N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-1-piperidinecarbothioamide IUPAC Name: (3R,5R)-N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethylpiperidine-1-carbothioamide Traditional Name: (3R,5R)-3,5-dimethyl-N-piperonyl-piperidine-1-carbothioamide Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=S)NCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C(=S)NCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C16H22N2O2S/c1-11-5-12(2)9-18(8-11)16(21)17-7-13-3-4-14-15(6-13)20-10-19-14/h3-4,6,11-12H,5,7-10H2,1-2H3,(H,17,21)/t11-,12-/m1/s1