6-azanyl-3-methyl-1-(phenylmethyl)-5-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-1-(phenylmethyl)-5-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-benzyl-3-methyl-5-[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-5-[1-oxo-2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]ethyl]-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-3-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-benzyl-3-methyl-5-[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetyl]pyrimidine-2,4-quinone Formula: C23H27N6O3+ MolecularWeight: 435.49888

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C23H26N6O3/c1-26-22(31)20(21(24)29(23(26)32)15-17-7-3-2-4-8-17)18(30)16-27-11-13-28(14-12-27)19-9-5-6-10-25-19/h2-10H,11-16,24H2,1H3/p+1