[5-butyl-2-(ethylamino)-6-methyl-pyrimidin-4-yl]methanesulfonic acid

Systemtic Name: [5-butyl-2-(ethylamino)-6-methyl-pyrimidin-4-yl]methanesulfonic acid Openeye Name: [5-butyl-2-(ethylamino)-6-methyl-pyrimidin-4-yl]methanesulfonic acid CAS Name: [5-butyl-2-(ethylamino)-6-methyl-4-pyrimidinyl]methanesulfonic acid IUPAC Name: [5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl]methanesulfonic acid Traditional Name: [5-butyl-2-(ethylamino)-6-methyl-pyrimidin-4-yl]methanesulfonic acid Formula: C12H21N3O3S MolecularWeight: 287.37844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(N=C1CS(=O)(=O)O)NCC)C

Isomeric SMILES

CCCCC1=C(N=C(N=C1CS(=O)(=O)O)NCC)C

InChI

InChI=1S/C12H21N3O3S/c1-4-6-7-10-9(3)14-12(13-5-2)15-11(10)8-19(16,17)18/h4-8H2,1-3H3,(H,13,14,15)(H,16,17,18)