zinc; N,N-di(butan-2-yl)carbamothioate; methanidylbenzene; chloride

Systemtic Name: zinc; N,N-di(butan-2-yl)carbamothioate; methanidylbenzene; chloride Openeye Name: zinc; N,N-disec-butylcarbamothioate; methanidylbenzene; chloride CAS Name: zinc; N,N-di(butan-2-yl)carbamothioate; methanidylbenzene; chloride IUPAC Name: zinc; N,N-di(butan-2-yl)carbamothioate; methanidylbenzene; chloride Traditional Name: zinc; N,N-disec-butylthiocarbamate; methanidylbenzene; chloride Formula: C25H43ClN2O2S2Zn-2 MolecularWeight: 568.61312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C(C)CC)C(=S)[O-].CCC(C)N(C(C)CC)C(=S)[O-].[CH2-]C1=CC=CC=C1.[Cl-].[Zn+2]

Isomeric SMILES

CCC(C)N(C(C)CC)C(=S)[O-].CCC(C)N(C(C)CC)C(=S)[O-].[CH2-]C1=CC=CC=C1.[Cl-].[Zn+2]

InChI

InChI=1S/2C9H19NOS.C7H7.ClH.Zn/c2*1-5-7(3)10(9(11)12)8(4)6-2;1-7-5-3-2-4-6-7;;/h2*7-8H,5-6H2,1-4H3,(H,11,12);2-6H,1H2;1H;/q;;-1;;+2/p-3