1,3-dimethyl-5-(phenylmethyl)-7-prop-2-ynoxy-imidazo[4,5-d]pyridazine-2,4-dione

Systemtic Name: 1,3-dimethyl-5-(phenylmethyl)-7-prop-2-ynoxy-imidazo[4,5-d]pyridazine-2,4-dione Openeye Name: 5-benzyl-1,3-dimethyl-7-prop-2-ynoxy-imidazo[4,5-d]pyridazine-2,4-dione CAS Name: 1,3-dimethyl-5-(phenylmethyl)-7-prop-2-ynoxyimidazo[4,5-d]pyridazine-2,4-dione IUPAC Name: 5-benzyl-1,3-dimethyl-7-prop-2-ynoxyimidazo[4,5-d]pyridazine-2,4-dione Traditional Name: 5-benzyl-1,3-dimethyl-7-propargyloxy-imidazo[4,5-d]pyridazine-2,4-quinone Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(N=C2OCC#C)CC3=CC=CC=C3)N(C1=O)C

Isomeric SMILES

CN1C2=C(C(=O)N(N=C2OCC#C)CC3=CC=CC=C3)N(C1=O)C

InChI

InChI=1S/C17H16N4O3/c1-4-10-24-15-13-14(20(3)17(23)19(13)2)16(22)21(18-15)11-12-8-6-5-7-9-12/h1,5-9H,10-11H2,2-3H3