5-(azepan-4-yl)-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(azepan-4-yl)-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(azepan-4-yl)-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(4-azepanyl)-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(azepan-4-yl)-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(azepan-4-yl)-1,3-dimethyl-barbituric acid Formula: C12H19N3O3 MolecularWeight: 253.29756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=O)N(C1=O)C)C2CCCNCC2

Isomeric SMILES

CN1C(=O)C(C(=O)N(C1=O)C)C2CCCNCC2

InChI

InChI=1S/C12H19N3O3/c1-14-10(16)9(11(17)15(2)12(14)18)8-4-3-6-13-7-5-8/h8-9,13H,3-7H2,1-2H3