(5-butyl-6-methyl-2-pyrrolidin-1-yl-pyrimidin-4-yl) methanesulfonate

Systemtic Name: (5-butyl-6-methyl-2-pyrrolidin-1-yl-pyrimidin-4-yl) methanesulfonate Openeye Name: (5-butyl-6-methyl-2-pyrrolidin-1-yl-pyrimidin-4-yl) methanesulfonate CAS Name: methanesulfonic acid [5-butyl-6-methyl-2-(1-pyrrolidinyl)-4-pyrimidinyl] ester IUPAC Name: (5-butyl-6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl) methanesulfonate Traditional Name: methanesulfonic acid (5-butyl-6-methyl-2-pyrrolidino-pyrimidin-4-yl) ester Formula: C14H23N3O3S MolecularWeight: 313.41572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(N=C1OS(=O)(=O)C)N2CCCC2)C

Isomeric SMILES

CCCCC1=C(N=C(N=C1OS(=O)(=O)C)N2CCCC2)C

InChI

InChI=1S/C14H23N3O3S/c1-4-5-8-12-11(2)15-14(17-9-6-7-10-17)16-13(12)20-21(3,18)19/h4-10H2,1-3H3