1-[(3-bromophenyl)methyl]-4,6-dimethyl-3-prop-2-enoxy-pyrazolo[4,3-d]pyrimidine-5,7-dione

Systemtic Name: 1-[(3-bromophenyl)methyl]-4,6-dimethyl-3-prop-2-enoxy-pyrazolo[4,3-d]pyrimidine-5,7-dione Openeye Name: 3-allyloxy-1-[(3-bromophenyl)methyl]-4,6-dimethyl-pyrazolo[4,3-d]pyrimidine-5,7-dione CAS Name: 1-[(3-bromophenyl)methyl]-4,6-dimethyl-3-prop-2-enoxypyrazolo[4,3-d]pyrimidine-5,7-dione IUPAC Name: 1-[(3-bromophenyl)methyl]-4,6-dimethyl-3-prop-2-enoxypyrazolo[4,3-d]pyrimidine-5,7-dione Traditional Name: 3-allyloxy-1-(3-bromobenzyl)-4,6-dimethyl-pyrazolo[4,3-d]pyrimidine-5,7-quinone Formula: C17H17BrN4O3 MolecularWeight: 405.24588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrN4O3/c1-4-8-25-15-13-14(16(23)21(3)17(24)20(13)2)22(19-15)10-11-6-5-7-12(18)9-11/h4-7,9H,1,8,10H2,2-3H3