S-dodecyl N-[[1-(tert-butyldiazenyl)-1-cyclohexyl-2-methyl-propyl]carbamothioylamino]carbamothioate

Systemtic Name: S-dodecyl N-[[1-(tert-butyldiazenyl)-1-cyclohexyl-2-methyl-propyl]carbamothioylamino]carbamothioate Openeye Name: S-dodecyl N-[(1-tert-butylazo-1-cyclohexyl-2-methyl-propyl)carbamothioylamino]carbamothioate CAS Name: N-[[[(1-tert-butylazo-1-cyclohexyl-2-methylpropyl)amino]-sulfanylidenemethyl]amino]carbamothioic acid S-dodecyl ester IUPAC Name: S-dodecyl N-[[1-(tert-butyldiazenyl)-1-cyclohexyl-2-methylpropyl]carbamothioylamino]carbamothioate Traditional Name: N-[(1-tert-butylazo-1-cyclohexyl-2-methyl-propyl)thiocarbamoylamino]thiocarbamic acid S-lauryl ester Formula: C28H55N5OS2 MolecularWeight: 541.8992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=O)NNC(=S)NC(C1CCCCC1)(C(C)C)N=NC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCSC(=O)NNC(=S)NC(C1CCCCC1)(C(C)C)N=NC(C)(C)C

InChI

InChI=1S/C28H55N5OS2/c1-7-8-9-10-11-12-13-14-15-19-22-36-26(34)31-30-25(35)29-28(23(2)3,33-32-27(4,5)6)24-20-17-16-18-21-24/h23-24H,7-22H2,1-6H3,(H,31,34)(H2,29,30,35)