N-(1,3-benzodioxol-5-yl)-1-(2-dimethylaminoethylcarbamothioyl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(2-dimethylaminoethylcarbamothioyl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(2-dimethylaminoethylcarbamothioyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(2-dimethylaminoethylamino)-sulfanylidenemethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(2-dimethylaminoethylcarbamothioyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(2-dimethylaminoethylthiocarbamoyl)isonipecotamide Formula: C18H26N4O3S MolecularWeight: 378.48904

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(C)CCNC(=S)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H26N4O3S/c1-21(2)10-7-19-18(26)22-8-5-13(6-9-22)17(23)20-14-3-4-15-16(11-14)25-12-24-15/h3-4,11,13H,5-10,12H2,1-2H3,(H,19,26)(H,20,23)