2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methylcarbamoyl]quinazolin-4-olate

Systemtic Name: 2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methylcarbamoyl]quinazolin-4-olate Openeye Name: 2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methylcarbamoyl]quinazolin-4-olate CAS Name: 2-[[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methylamino]-oxomethyl]-4-quinazolinolate IUPAC Name: 2-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methylcarbamoyl]quinazolin-4-olate Traditional Name: 2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methylcarbamoyl]quinazolin-4-olate Formula: C17H18N5O2- MolecularWeight: 324.35712

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CNC(=O)C2=NC3=CC=CC=C3C(=N2)[O-])C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CNC(=O)C2=NC3=CC=CC=C3C(=N2)[O-])C

InChI

InChI=1S/C17H19N5O2/c1-4-22-11(3)13(10(2)21-22)9-18-17(24)15-19-14-8-6-5-7-12(14)16(23)20-15/h5-8H,4,9H2,1-3H3,(H,18,24)(H,19,20,23)/p-1