3-butyl-6,7,8,9-tetradeuterio-10H-pyrimido[1,2-a]benzimidazole-2,4-dione

Systemtic Name: 3-butyl-6,7,8,9-tetradeuterio-10H-pyrimido[1,2-a]benzimidazole-2,4-dione Openeye Name: 3-butyl-6,7,8,9-tetradeuterio-10H-pyrimido[1,2-a]benzimidazole-2,4-dione CAS Name: 3-butyl-6,7,8,9-tetradeuterio-10H-pyrimido[1,2-a]benzimidazole-2,4-dione IUPAC Name: 3-butyl-6,7,8,9-tetradeuterio-10H-pyrimido[1,2-a]benzimidazole-2,4-dione Traditional Name: 3-butyl-6,7,8,9-tetradeuterio-10H-pyrimido[1,2-a]benzimidazole-2,4-quinone Formula: C14H15N3O2 MolecularWeight: 261.312447

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N=C2NC3=CC=CC=C3N2C1=O

Isomeric SMILES

[2H]C1=C(C(=C2C(=C1[2H])NC3=NC(=O)C(C(=O)N23)CCCC)[2H])[2H]

InChI

InChI=1S/C14H15N3O2/c1-2-3-6-9-12(18)16-14-15-10-7-4-5-8-11(10)17(14)13(9)19/h4-5,7-9H,2-3,6H2,1H3,(H,15,16,18)/i4D,5D,7D,8D