[6,8-bis(iodanyl)-4-oxidanylidene-3-(piperidin-1-ylmethyl)-2H-chromen-3-yl] piperidine-1-carbodithioate

Systemtic Name: [6,8-bis(iodanyl)-4-oxidanylidene-3-(piperidin-1-ylmethyl)-2H-chromen-3-yl] piperidine-1-carbodithioate Openeye Name: [6,8-diiodo-4-oxo-3-(1-piperidylmethyl)chroman-3-yl] piperidine-1-carbodithioate CAS Name: 1-piperidinecarbodithioic acid [6,8-diiodo-4-oxo-3-(1-piperidinylmethyl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6,8-diiodo-4-oxo-3-(piperidin-1-ylmethyl)-2H-chromen-3-yl] piperidine-1-carbodithioate Traditional Name: piperidine-1-carbodithioic acid [6,8-diiodo-4-keto-3-(piperidinomethyl)chroman-3-yl] ester Formula: C21H26I2N2O2S2 MolecularWeight: 656.38228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2(COC3=C(C=C(C=C3C2=O)I)I)SC(=S)N4CCCCC4

Isomeric SMILES

C1CCN(CC1)CC2(COC3=C(C=C(C=C3C2=O)I)I)SC(=S)N4CCCCC4

InChI

InChI=1S/C21H26I2N2O2S2/c22-15-11-16-18(17(23)12-15)27-14-21(19(16)26,13-24-7-3-1-4-8-24)29-20(28)25-9-5-2-6-10-25/h11-12H,1-10,13-14H2