2-[3-azanyl-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-yl]-1-(4-methoxyphenyl)ethanone

Systemtic Name: 2-[3-azanyl-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-yl]-1-(4-methoxyphenyl)ethanone Openeye Name: 2-[3-amino-6-[2-(4-methoxyphenyl)-2-oxo-ethyl]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-yl]-1-(4-methoxyphenyl)ethanone CAS Name: 2-[3-amino-6-[2-(4-methoxyphenyl)-2-oxoethyl]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-yl]-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-[3-amino-6-[2-(4-methoxyphenyl)-2-oxoethyl]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-yl]-1-(4-methoxyphenyl)ethanone Traditional Name: 2-[3-amino-6-[2-keto-2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-yl]-1-(4-methoxyphenyl)ethanone Formula: C22H20N6O4 MolecularWeight: 432.432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC2=NC3=NN=C(N3N=C2CC(=O)C4=CC=C(C=C4)OC)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CC2=NC3=NN=C(N3N=C2CC(=O)C4=CC=C(C=C4)OC)N

InChI

InChI=1S/C22H20N6O4/c1-31-15-7-3-13(4-8-15)19(29)11-17-18(27-28-21(23)25-26-22(28)24-17)12-20(30)14-5-9-16(32-2)10-6-14/h3-10H,11-12H2,1-2H3,(H2,23,25)