6-oxidanylidene-N,1,8-triphenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazine-3-carboxamide

Systemtic Name: 6-oxidanylidene-N,1,8-triphenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazine-3-carboxamide Openeye Name: 6-oxo-N,1,8-triphenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazine-3-carboxamide CAS Name: 6-oxo-N,1,8-triphenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazine-3-carboxamide IUPAC Name: 6-oxo-N,1,8-triphenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazine-3-carboxamide Traditional Name: 6-keto-N,1,8-triphenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazine-3-carboxamide Formula: C24H18N6O2 MolecularWeight: 422.43872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N3C(=N2)N(N=C(N3)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N3C(=N2)N(N=C(N3)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H18N6O2/c31-21-16-20(17-10-4-1-5-11-17)26-24-29(19-14-8-3-9-15-19)27-22(28-30(21)24)23(32)25-18-12-6-2-7-13-18/h1-16H,(H,25,32)(H,27,28)