sodium [[1-cyclohexyl-3,4-dimethyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]amino]methanesulfonate

Systemtic Name: sodium [[1-cyclohexyl-3,4-dimethyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]amino]methanesulfonate Openeye Name: sodium [(1-cyclohexyl-3,4-dimethyl-2,6-dioxo-pyrimidin-5-yl)amino]methanesulfonate CAS Name: sodium [(1-cyclohexyl-3,4-dimethyl-2,6-dioxo-5-pyrimidinyl)amino]methanesulfonate IUPAC Name: sodium [(1-cyclohexyl-3,4-dimethyl-2,6-dioxopyrimidin-5-yl)amino]methanesulfonate Traditional Name: sodium [(1-cyclohexyl-2,6-diketo-3,4-dimethyl-pyrimidin-5-yl)amino]methanesulfonate Formula: C13H20N3NaO5S MolecularWeight: 353.36977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)N1C)C2CCCCC2)NCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=C(C(=O)N(C(=O)N1C)C2CCCCC2)NCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C13H21N3O5S.Na/c1-9-11(14-8-22(19,20)21)12(17)16(13(18)15(9)2)10-6-4-3-5-7-10;/h10,14H,3-8H2,1-2H3,(H,19,20,21);/q;+1/p-1