4-methyl-2-[(3-methylphenyl)methyl]-4-oxidanyl-2-propan-2-yl-piperazin-4-ium-1-carbodithioic acid

Systemtic Name: 4-methyl-2-[(3-methylphenyl)methyl]-4-oxidanyl-2-propan-2-yl-piperazin-4-ium-1-carbodithioic acid Openeye Name: 4-hydroxy-2-isopropyl-4-methyl-2-(m-tolylmethyl)piperazin-4-ium-1-carbodithioic acid CAS Name: 4-hydroxy-4-methyl-2-[(3-methylphenyl)methyl]-2-propan-2-yl-1-piperazin-4-iumcarbodithioic acid IUPAC Name: 4-hydroxy-4-methyl-2-[(3-methylphenyl)methyl]-2-propan-2-ylpiperazin-4-ium-1-carbodithioic acid Traditional Name: 4-hydroxy-2-isopropyl-4-methyl-2-(3-methylbenzyl)piperazin-4-ium-1-carbodithioic acid Formula: C17H27N2OS2+ MolecularWeight: 339.53908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2(C[N+](CCN2C(=S)S)(C)O)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2(C[N+](CCN2C(=S)S)(C)O)C(C)C

InChI

InChI=1S/C17H26N2OS2/c1-13(2)17(11-15-7-5-6-14(3)10-15)12-19(4,20)9-8-18(17)16(21)22/h5-7,10,13,20H,8-9,11-12H2,1-4H3/p+1