1-(1,3-benzodioxol-5-ylmethylcarbamothioyl)piperidine-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethylcarbamothioyl)piperidine-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethylcarbamothioyl)piperidine-3-carboxamide CAS Name: 1-[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]-3-piperidinecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethylcarbamothioyl)piperidine-3-carboxamide Traditional Name: 1-(piperonylthiocarbamoyl)nipecotamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=S)NCC2=CC3=C(C=C2)OCO3)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C(=S)NCC2=CC3=C(C=C2)OCO3)C(=O)N

InChI

InChI=1S/C15H19N3O3S/c16-14(19)11-2-1-5-18(8-11)15(22)17-7-10-3-4-12-13(6-10)21-9-20-12/h3-4,6,11H,1-2,5,7-9H2,(H2,16,19)(H,17,22)