5-chloranyl-1,3-benzothiazole-2-thiolate; dibutyltin(2+)

Systemtic Name: 5-chloranyl-1,3-benzothiazole-2-thiolate; dibutyltin(2+) Openeye Name: 5-chloro-1,3-benzothiazole-2-thiolate; dibutyltin(2+) CAS Name: 5-chloro-1,3-benzothiazole-2-thiolate; dibutyltin(2+) IUPAC Name: 5-chloro-1,3-benzothiazole-2-thiolate; dibutyltin(2+) Traditional Name: 5-chloro-1,3-benzothiazole-2-thiolate; dibutyltin(2+) Formula: C22H24Cl2N2S4Sn MolecularWeight: 634.31536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+2]CCCC.C1=CC2=C(C=C1Cl)N=C(S2)[S-].C1=CC2=C(C=C1Cl)N=C(S2)[S-]

Isomeric SMILES

CCCC[Sn+2]CCCC.C1=CC2=C(C=C1Cl)N=C(S2)[S-].C1=CC2=C(C=C1Cl)N=C(S2)[S-]

InChI

InChI=1S/2C7H4ClNS2.2C4H9.Sn/c2*8-4-1-2-6-5(3-4)9-7(10)11-6;2*1-3-4-2;/h2*1-3H,(H,9,10);2*1,3-4H2,2H3;/q;;;;+2/p-2