2-[[4-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[1-oxo-2-(1,3,5-trimethyl-4-pyrazolyl)ethyl]-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]piperazino]methyl]-1H-quinazolin-4-one Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CC(=O)N2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C(=NN1C)C)CC(=O)N2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H26N6O2/c1-14-17(15(2)25(3)24-14)12-20(28)27-10-8-26(9-11-27)13-19-22-18-7-5-4-6-16(18)21(29)23-19/h4-7H,8-13H2,1-3H3,(H,22,23,29)