2-[N-(carbamothioylamino)-N'-phenyl-carbamimidoyl]phenolate; triphenylstannanylium

Systemtic Name: 2-[N-(carbamothioylamino)-N'-phenyl-carbamimidoyl]phenolate; triphenylstannanylium Openeye Name: 2-[N-(carbamothioylamino)-N'-phenyl-carbamimidoyl]phenolate; triphenylstannanylium CAS Name: 2-[(carbamothioylhydrazo)-phenyliminomethyl]phenolate; triphenylstannanylium IUPAC Name: 2-[N-(carbamothioylamino)-N'-phenylcarbamimidoyl]phenolate; triphenylstannanylium Traditional Name: 2-(N'-phenyl-N-thioureido-amidino)phenolate; triphenylstannanylium Formula: C32H28N4OSSn MolecularWeight: 635.36592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(C2=CC=CC=C2[O-])NNC(=S)N.C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N=C(C2=CC=CC=C2[O-])NNC(=S)N.C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C14H14N4OS.3C6H5.Sn/c15-14(20)18-17-13(11-8-4-5-9-12(11)19)16-10-6-2-1-3-7-10;3*1-2-4-6-5-3-1;/h1-9,19H,(H,16,17)(H3,15,18,20);3*1-5H;/q;;;;+1/p-1