1-butyl-3,6-diphenyl-pyrimido[5,4-e][1,2,4]triazine-5,7-dione

Systemtic Name: 1-butyl-3,6-diphenyl-pyrimido[5,4-e][1,2,4]triazine-5,7-dione Openeye Name: 1-butyl-3,6-diphenyl-pyrimido[5,4-e][1,2,4]triazine-5,7-dione CAS Name: 1-butyl-3,6-diphenylpyrimido[5,4-e][1,2,4]triazine-5,7-dione IUPAC Name: 1-butyl-3,6-diphenylpyrimido[5,4-e][1,2,4]triazine-5,7-dione Traditional Name: 1-butyl-3,6-diphenyl-pyrimido[5,4-e][1,2,4]triazine-5,7-quinone Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NC(=O)N(C(=O)C2=NC(=N1)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C2=NC(=O)N(C(=O)C2=NC(=N1)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O2/c1-2-3-14-25-19-17(22-18(24-25)15-10-6-4-7-11-15)20(27)26(21(28)23-19)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3