7-oxidanylidene-2-selanylidene-6H-[1,3]dithiolo[4,5-d]pyrimidin-5-olate; tetrabutylazanium

Systemtic Name: 7-oxidanylidene-2-selanylidene-6H-[1,3]dithiolo[4,5-d]pyrimidin-5-olate; tetrabutylazanium Openeye Name: 7-oxo-2-selenoxo-6H-[1,3]dithiolo[4,5-d]pyrimidin-5-olate; tetrabutylammonium CAS Name: 7-oxo-2-selanylidene-6H-[1,3]dithiolo[4,5-d]pyrimidin-5-olate; tetrabutylammonium IUPAC Name: 7-oxo-2-selanylidene-6H-[1,3]dithiolo[4,5-d]pyrimidin-5-olate; tetrabutylazanium Traditional Name: 7-keto-2-selenoxo-6H-[1,3]dithiolo[4,5-d]pyrimidin-5-olate; tetrabutylammonium Formula: C21H37N3O2S2Se MolecularWeight: 506.62738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C12=C(N=C(NC1=O)[O-])SC(=[Se])S2

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C12=C(N=C(NC1=O)[O-])SC(=[Se])S2

InChI

InChI=1S/C16H36N.C5H2N2O2S2Se/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;8-2-1-3(7-4(9)6-2)11-5(12)10-1/h5-16H2,1-4H3;(H2,6,7,8,9)/q+1;/p-1