[(2S)-4-methyl-1-[2-[(E)-[4-methyl-2,6-bis(oxidanylidene)pyrimidin-5-ylidene]methyl]hydrazinyl]-1-oxidanylidene-pentan-2-yl]azanium chloride

Systemtic Name: [(2S)-4-methyl-1-[2-[(E)-[4-methyl-2,6-bis(oxidanylidene)pyrimidin-5-ylidene]methyl]hydrazinyl]-1-oxidanylidene-pentan-2-yl]azanium chloride Openeye Name: [(1S)-3-methyl-1-[[[(E)-(4-methyl-2,6-dioxo-pyrimidin-5-ylidene)methyl]amino]carbamoyl]butyl]ammonium chloride CAS Name: [(2S)-4-methyl-1-[[(E)-(4-methyl-2,6-dioxo-5-pyrimidinylidene)methyl]hydrazo]-1-oxopentan-2-yl]ammonium chloride IUPAC Name: [(2S)-4-methyl-1-[2-[(E)-(4-methyl-2,6-dioxopyrimidin-5-ylidene)methyl]hydrazinyl]-1-oxopentan-2-yl]azanium chloride Traditional Name: [(1S)-1-[[[(E)-(2,6-diketo-4-methyl-pyrimidin-5-ylidene)methyl]amino]carbamoyl]-3-methyl-butyl]ammonium chloride Formula: C12H20ClN5O3 MolecularWeight: 317.7719

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)NC(=O)C1=CNNC(=O)C(CC(C)C)[NH3+].[Cl-]

Isomeric SMILES

CC\1=NC(=O)NC(=O)/C1=C/NNC(=O)[C@H](CC(C)C)[NH3+].[Cl-]

InChI

InChI=1S/C12H19N5O3.ClH/c1-6(2)4-9(13)11(19)17-14-5-8-7(3)15-12(20)16-10(8)18;/h5-6,9,14H,4,13H2,1-3H3,(H,17,19)(H,16,18,20);1H/b8-5+;/t9-;/m0./s1