N-[[1-(1,3-benzodioxol-5-ylcarbamothioyl)piperidin-4-yl]methyl]ethanamide

Systemtic Name: N-[[1-(1,3-benzodioxol-5-ylcarbamothioyl)piperidin-4-yl]methyl]ethanamide Openeye Name: N-[[1-(1,3-benzodioxol-5-ylcarbamothioyl)-4-piperidyl]methyl]acetamide CAS Name: N-[[1-[(1,3-benzodioxol-5-ylamino)-sulfanylidenemethyl]-4-piperidinyl]methyl]acetamide IUPAC Name: N-[[1-(1,3-benzodioxol-5-ylcarbamothioyl)piperidin-4-yl]methyl]acetamide Traditional Name: N-[[1-(1,3-benzodioxol-5-ylthiocarbamoyl)-4-piperidyl]methyl]acetamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CCN(CC1)C(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)NCC1CCN(CC1)C(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H21N3O3S/c1-11(20)17-9-12-4-6-19(7-5-12)16(23)18-13-2-3-14-15(8-13)22-10-21-14/h2-3,8,12H,4-7,9-10H2,1H3,(H,17,20)(H,18,23)