3-ethyl-6-methyl-5-(4-pentanoylpiperazin-1-yl)-1-phenyl-pyrimidine-2,4-dione

Systemtic Name: 3-ethyl-6-methyl-5-(4-pentanoylpiperazin-1-yl)-1-phenyl-pyrimidine-2,4-dione Openeye Name: 3-ethyl-6-methyl-5-(4-pentanoylpiperazin-1-yl)-1-phenyl-pyrimidine-2,4-dione CAS Name: 3-ethyl-6-methyl-5-[4-(1-oxopentyl)-1-piperazinyl]-1-phenylpyrimidine-2,4-dione IUPAC Name: 3-ethyl-6-methyl-5-(4-pentanoylpiperazin-1-yl)-1-phenylpyrimidine-2,4-dione Traditional Name: 3-ethyl-6-methyl-1-phenyl-5-(4-valerylpiperazino)pyrimidine-2,4-quinone Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=C(N(C(=O)N(C2=O)CC)C3=CC=CC=C3)C

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=C(N(C(=O)N(C2=O)CC)C3=CC=CC=C3)C

InChI

InChI=1S/C22H30N4O3/c1-4-6-12-19(27)23-13-15-24(16-14-23)20-17(3)26(18-10-8-7-9-11-18)22(29)25(5-2)21(20)28/h7-11H,4-6,12-16H2,1-3H3