[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] 4-methylpiperidine-1-carbodithioate

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] 4-methylpiperidine-1-carbodithioate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] 4-methylpiperidine-1-carbodithioate CAS Name: 4-methyl-1-piperidinecarbodithioic acid [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 4-methylpiperidine-1-carbodithioate Traditional Name: 4-methylpiperidine-1-carbodithioic acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester Formula: C16H20N2O3S2 MolecularWeight: 352.4716

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)SCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1CCN(CC1)C(=S)SCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H20N2O3S2/c1-11-4-6-18(7-5-11)16(22)23-9-15(19)17-12-2-3-13-14(8-12)21-10-20-13/h2-3,8,11H,4-7,9-10H2,1H3,(H,17,19)