2,4-bis(oxidanylidene)-6-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 2,4-bis(oxidanylidene)-6-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 2,4-dioxo-6-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile CAS Name: 2,4-dioxo-6-[2-(1-pyrrolidin-1-iumyl)ethylthio]-1H-thieno[3,2-d]pyrimidine-7-carbonitrile IUPAC Name: 2,4-dioxo-6-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 2,4-diketo-6-(2-pyrrolidin-1-ium-1-ylethylthio)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Formula: C13H15N4O2S2+ MolecularWeight: 323.4138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCSC2=C(C3=C(S2)C(=O)NC(=O)N3)C#N

Isomeric SMILES

C1CC[NH+](C1)CCSC2=C(C3=C(S2)C(=O)NC(=O)N3)C#N

InChI

InChI=1S/C13H14N4O2S2/c14-7-8-9-10(11(18)16-13(19)15-9)21-12(8)20-6-5-17-3-1-2-4-17/h1-6H2,(H2,15,16,18,19)/p+1