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

Systemtic Name: benzenethiolate; 5-chloranyl-1,3-benzothiazole-2-thiolate; diphenyltin(2+) Openeye Name: benzenethiolate; 5-chloro-1,3-benzothiazole-2-thiolate; diphenyltin(2+) CAS Name: benzenethiolate; 5-chloro-1,3-benzothiazole-2-thiolate; diphenyltin(2+) IUPAC Name: benzenethiolate; 5-chloro-1,3-benzothiazole-2-thiolate; diphenyltin(2+) Traditional Name: benzenethiolate; 5-chloro-1,3-benzothiazole-2-thiolate; diphenyltin(2+) Formula: C25H18ClNS3Sn MolecularWeight: 582.77512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[S-].C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2.C1=CC2=C(C=C1Cl)N=C(S2)[S-]

Isomeric SMILES

C1=CC=C(C=C1)[S-].C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2.C1=CC2=C(C=C1Cl)N=C(S2)[S-]

InChI

InChI=1S/C7H4ClNS2.C6H6S.2C6H5.Sn/c8-4-1-2-6-5(3-4)9-7(10)11-6;7-6-4-2-1-3-5-6;2*1-2-4-6-5-3-1;/h1-3H,(H,9,10);1-5,7H;2*1-5H;/q;;;;+2/p-2