N-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-methyl-propanamide hydrate

Systemtic Name: N-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-methyl-propanamide hydrate Openeye Name: N-(2,4-dioxopyrimidin-1-yl)-2-methyl-propanamide hydrate CAS Name: N-(2,4-dioxo-1-pyrimidinyl)-2-methylpropanamide hydrate IUPAC Name: N-(2,4-dioxopyrimidin-1-yl)-2-methylpropanamide hydrate Traditional Name: N-(2,4-diketopyrimidin-1-yl)-2-methyl-propionamide hydrate Formula: C8H13N3O4 MolecularWeight: 215.20652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NN1C=CC(=O)NC1=O.O

Isomeric SMILES

CC(C)C(=O)NN1C=CC(=O)NC1=O.O

InChI

InChI=1S/C8H11N3O3.H2O/c1-5(2)7(13)10-11-4-3-6(12)9-8(11)14;/h3-5H,1-2H3,(H,10,13)(H,9,12,14);1H2