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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(2-methylprop-2-enylcarbamothioyl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(2-methylallylcarbamothioyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(2-methylprop-2-enylamino)-sulfanylidenemethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(2-methylprop-2-enylcarbamothioyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(2-methylallylthiocarbamoyl)isonipecotamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC(=S)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=C)CNC(=S)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H23N3O3S/c1-12(2)10-19-18(25)21-7-5-13(6-8-21)17(22)20-14-3-4-15-16(9-14)24-11-23-15/h3-4,9,13H,1,5-8,10-11H2,2H3,(H,19,25)(H,20,22)