(1S)-1-[(6R)-2-azanyl-1,4,5,6-tetrahydropyrimidin-3-ium-6-yl]propan-1-ol; methanesulfonate

Systemtic Name: (1S)-1-[(6R)-2-azanyl-1,4,5,6-tetrahydropyrimidin-3-ium-6-yl]propan-1-ol; methanesulfonate Openeye Name: (1S)-1-[(6R)-2-amino-1,4,5,6-tetrahydropyrimidin-3-ium-6-yl]propan-1-ol; methanesulfonate CAS Name: (1S)-1-[(6R)-2-amino-1,4,5,6-tetrahydropyrimidin-3-ium-6-yl]-1-propanol; methanesulfonate IUPAC Name: (1S)-1-[(6R)-2-amino-1,4,5,6-tetrahydropyrimidin-3-ium-6-yl]propan-1-ol; methanesulfonate Traditional Name: (1S)-1-[(6R)-2-amino-1,4,5,6-tetrahydropyrimidin-3-ium-6-yl]propan-1-ol mesylate Formula: C8H19N3O4S MolecularWeight: 253.31916

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CC[NH+]=C(N1)N)O.CS(=O)(=O)[O-]

Isomeric SMILES

CC[C@@H]([C@H]1CC[NH+]=C(N1)N)O.CS(=O)(=O)[O-]

InChI

InChI=1S/C7H15N3O.CH4O3S/c1-2-6(11)5-3-4-9-7(8)10-5;1-5(2,3)4/h5-6,11H,2-4H2,1H3,(H3,8,9,10);1H3,(H,2,3,4)/t5-,6+;/m1./s1