(4-azanyl-1,2-dimethyl-pyrimidin-1-ium-5-yl)methanesulfonate

Systemtic Name: (4-azanyl-1,2-dimethyl-pyrimidin-1-ium-5-yl)methanesulfonate Openeye Name: (4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methanesulfonate CAS Name: (4-amino-1,2-dimethyl-5-pyrimidin-1-iumyl)methanesulfonate IUPAC Name: (4-amino-1,2-dimethylpyrimidin-1-ium-5-yl)methanesulfonate Traditional Name: (4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methanesulfonate Formula: C7H11N3O3S MolecularWeight: 217.24554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=N1)N)CS(=O)(=O)[O-])C

Isomeric SMILES

CC1=[N+](C=C(C(=N1)N)CS(=O)(=O)[O-])C

InChI

InChI=1S/C7H11N3O3S/c1-5-9-7(8)6(3-10(5)2)4-14(11,12)13/h3,8H,4H2,1-2H3,(H,11,12,13)