butane; [C-(phenylmethylsulfanyl)-N-(1-pyridin-2-ylethylideneamino)carbonimidoyl]sulfanium; tin

Systemtic Name: butane; [C-(phenylmethylsulfanyl)-N-(1-pyridin-2-ylethylideneamino)carbonimidoyl]sulfanium; tin Openeye Name: [C-benzylsulfanyl-N-[1-(2-pyridyl)ethylideneamino]carbonimidoyl]sulfonium; butane; tin CAS Name: butane; [(phenylmethylthio)-[1-(2-pyridinyl)ethylidenehydrazinylidene]methyl]sulfonium; tin IUPAC Name: [C-benzylsulfanyl-N-(1-pyridin-2-ylethylideneamino)carbonimidoyl]sulfanium; butane; tin Traditional Name: [C-(benzylthio)-N-[1-(2-pyridyl)ethylideneamino]carbonimidoyl]sulfonium; butane; tin Formula: C38H50N6S4Sn MolecularWeight: 837.8138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[CH2-].CCC[CH2-].CC(=NN=C([SH2+])SCC1=CC=CC=C1)C2=CC=CC=N2.CC(=NN=C([SH2+])SCC1=CC=CC=C1)C2=CC=CC=N2.[Sn]

Isomeric SMILES

CCC[CH2-].CCC[CH2-].CC(=NN=C([SH2+])SCC1=CC=CC=C1)C2=CC=CC=N2.CC(=NN=C([SH2+])SCC1=CC=CC=C1)C2=CC=CC=N2.[Sn]

InChI

InChI=1S/2C15H15N3S2.2C4H9.Sn/c2*1-12(14-9-5-6-10-16-14)17-18-15(19)20-11-13-7-3-2-4-8-13;2*1-3-4-2;/h2*2-10H,11H2,1H3,(H,18,19);2*1,3-4H2,2H3;/q;;2*-1;/p+2