3-(1,3-benzodioxol-5-yl)-5-ethyl-7-methyl-imidazo[4,5-e][1,2,4]triazin-6-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-7-methyl-imidazo[4,5-e][1,2,4]triazin-6-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-7-methyl-imidazo[4,5-e][1,2,4]triazin-6-one CAS Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-7-methyl-6-imidazo[4,5-e][1,2,4]triazinone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-7-methylimidazo[4,5-e][1,2,4]triazin-6-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-7-methyl-imidazo[4,5-e][1,2,4]triazin-6-one Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=NC(=N2)C3=CC4=C(C=C3)OCO4)N(C1=O)C

Isomeric SMILES

CCN1C2=C(N=NC(=N2)C3=CC4=C(C=C3)OCO4)N(C1=O)C

InChI

InChI=1S/C14H13N5O3/c1-3-19-12-13(18(2)14(19)20)17-16-11(15-12)8-4-5-9-10(6-8)22-7-21-9/h4-6H,3,7H2,1-2H3