6-azanyl-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-amino-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-amino-2-[2-(1-pyrrolidin-1-iumyl)ethylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 6-amino-2-(2-pyrrolidin-1-ium-1-ylethylthio)-1H-pyrimidin-4-one Formula: C10H17N4OS+ MolecularWeight: 241.33318

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCSC2=NC(=O)C=C(N2)N

Isomeric SMILES

C1CC[NH+](C1)CCSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C10H16N4OS/c11-8-7-9(15)13-10(12-8)16-6-5-14-3-1-2-4-14/h7H,1-6H2,(H3,11,12,13,15)/p+1