trialuminum; N-butylcarbamodithioate; N-[5-(sulfanidylcarbothioylamino)pentyl]carbamodithioate; tetrabutylphosphanium

Systemtic Name: trialuminum; N-butylcarbamodithioate; N-[5-(sulfanidylcarbothioylamino)pentyl]carbamodithioate; tetrabutylphosphanium Openeye Name: trialuminum; N-butylcarbamodithioate; N-[5-(sulfidocarbothioylamino)pentyl]carbamodithioate; tetrabutylphosphonium CAS Name: trialuminum; N-butylcarbamodithioate; N-[5-[[sulfanylidene(sulfido)methyl]amino]pentyl]carbamodithioate; tetrabutylphosphonium IUPAC Name: trialuminum; N-butylcarbamodithioate; N-[5-(sulfidocarbothioylamino)pentyl]carbamodithioate; tetrabutylphosphanium Traditional Name: trialuminum; N-butylcarbamodithioate; N-[5-(sulfidocarbothioylamino)pentyl]carbamodithioate; tetrabutylphosphonium Formula: C96H196Al3N12P3S24 MolecularWeight: 2462.089737

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)[S-].CCCCNC(=S)[S-].CCCCNC(=S)[S-].CCCCNC(=S)[S-].CCCC[P+](CCCC)(CCCC)CCCC.CCCC[P+](CCCC)(CCCC)CCCC.CCCC[P+](CCCC)(CCCC)CCCC.C(CCNC(=S)[S-])CCNC(=S)[S-].C(CCNC(=S)[S-])CCNC(=S)[S-].C(CCNC(=S)[S-])CCNC(=S)[S-].C(CCNC(=S)[S-])CCNC(=S)[S-].[Al+3].[Al+3].[Al+3]

Isomeric SMILES

CCCCNC(=S)[S-].CCCCNC(=S)[S-].CCCCNC(=S)[S-].CCCCNC(=S)[S-].CCCC[P+](CCCC)(CCCC)CCCC.CCCC[P+](CCCC)(CCCC)CCCC.CCCC[P+](CCCC)(CCCC)CCCC.C(CCNC(=S)[S-])CCNC(=S)[S-].C(CCNC(=S)[S-])CCNC(=S)[S-].C(CCNC(=S)[S-])CCNC(=S)[S-].C(CCNC(=S)[S-])CCNC(=S)[S-].[Al+3].[Al+3].[Al+3]

InChI

InChI=1S/3C16H36P.4C7H14N2S4.4C5H11NS2.3Al/c3*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;4*10-6(11)8-4-2-1-3-5-9-7(12)13;4*1-2-3-4-6-5(7)8;;;/h3*5-16H2,1-4H3;4*1-5H2,(H2,8,10,11)(H2,9,12,13);4*2-4H2,1H3,(H2,6,7,8);;;/q3*+1;;;;;;;;;3*+3/p-12