chloranyl-[5-methyl-8-(3-methylpentylamino)-9-oxidanylidene-thioxanthen-2-yl]mercury

Systemtic Name: chloranyl-[5-methyl-8-(3-methylpentylamino)-9-oxidanylidene-thioxanthen-2-yl]mercury Openeye Name: chloro-[5-methyl-8-(3-methylpentylamino)-9-oxo-thioxanthen-2-yl]mercury CAS Name: chloro-[5-methyl-8-(3-methylpentylamino)-9-oxo-2-thioxanthenyl]mercury IUPAC Name: chloro-[5-methyl-8-(3-methylpentylamino)-9-oxothioxanthen-2-yl]mercury Traditional Name: chloro-[9-keto-5-methyl-8-(3-methylpentylamino)thioxanthen-2-yl]mercury Formula: C20H22ClHgNOS MolecularWeight: 560.50278

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCNC1=C2C(=C(C=C1)C)SC3=C(C2=O)C=C(C=C3)[Hg]Cl

Isomeric SMILES

CCC(C)CCNC1=C2C(=C(C=C1)C)SC3=C(C2=O)C=C(C=C3)[Hg]Cl

InChI

InChI=1S/C20H22NOS.ClH.Hg/c1-4-13(2)11-12-21-16-10-9-14(3)20-18(16)19(22)15-7-5-6-8-17(15)23-20;;/h6-10,13,21H,4,11-12H2,1-3H3;1H;/q;;+1/p-1