6-azanyl-1,3-dimethyl-5-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1,3-dimethyl-5-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1,3-dimethyl-5-[1-oxo-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1,3-dimethyl-5-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1,3-dimethyl-5-[2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetyl]pyrimidine-2,4-quinone Formula: C16H22N7O3+ MolecularWeight: 360.39098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH+]2CCN(CC2)C3=NC=CC=N3)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH+]2CCN(CC2)C3=NC=CC=N3)N

InChI

InChI=1S/C16H21N7O3/c1-20-13(17)12(14(25)21(2)16(20)26)11(24)10-22-6-8-23(9-7-22)15-18-4-3-5-19-15/h3-5H,6-10,17H2,1-2H3/p+1