4,6-dimethyl-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)pyrimidine

Systemtic Name: 4,6-dimethyl-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)pyrimidine Openeye Name: 4,6-dimethyl-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)pyrimidine CAS Name: 4,6-dimethyl-2-[2-(1-pyrrolidin-1-iumyl)ethylthio]pyrimidine IUPAC Name: 4,6-dimethyl-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)pyrimidine Traditional Name: 4,6-dimethyl-2-(2-pyrrolidin-1-ium-1-ylethylthio)pyrimidine Formula: C12H20N3S+ MolecularWeight: 238.3723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC[NH+]2CCCC2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC[NH+]2CCCC2)C

InChI

InChI=1S/C12H19N3S/c1-10-9-11(2)14-12(13-10)16-8-7-15-5-3-4-6-15/h9H,3-8H2,1-2H3/p+1