[1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate

Systemtic Name: [1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-1-methyl-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H18N2O3S2 MolecularWeight: 338.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC(=S)N3CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC(=S)N3CCCC3

InChI

InChI=1S/C15H18N2O3S2/c1-10(22-15(21)17-6-2-3-7-17)14(18)16-11-4-5-12-13(8-11)20-9-19-12/h4-5,8,10H,2-3,6-7,9H2,1H3,(H,16,18)