2-(3,5-dimethylpyrazol-1-yl)-6-ethyl-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]pyrimidin-4-one

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)-6-ethyl-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]pyrimidin-4-one Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-6-ethyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyrimidin-4-one CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-6-ethyl-3-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-4-pyrimidinone IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-6-ethyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyrimidin-4-one Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-6-ethyl-3-[2-keto-2-(4-phenylpiperazino)ethyl]pyrimidin-4-one Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N(C(=N1)N2C(=CC(=N2)C)C)CC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=O)N(C(=N1)N2C(=CC(=N2)C)C)CC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N6O2/c1-4-19-15-21(30)28(23(24-19)29-18(3)14-17(2)25-29)16-22(31)27-12-10-26(11-13-27)20-8-6-5-7-9-20/h5-9,14-15H,4,10-13,16H2,1-3H3