N-(4-ethanoylphenyl)-2-[(2R)-3-oxidanylidene-1-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanoyl]piperazin-2-yl]ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-[(2R)-3-oxidanylidene-1-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanoyl]piperazin-2-yl]ethanamide Openeye Name: N-(4-acetylphenyl)-2-[(2R)-3-oxo-1-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetyl]piperazin-2-yl]acetamide CAS Name: N-(4-acetylphenyl)-2-[(2R)-3-oxo-1-[1-oxo-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]ethyl]-2-piperazinyl]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[(2R)-3-oxo-1-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetyl]piperazin-2-yl]acetamide Traditional Name: N-(4-acetylphenyl)-2-[(2R)-3-keto-1-[2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetyl]piperazin-2-yl]acetamide Formula: C24H30N7O4+ MolecularWeight: 480.5395

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)NCCN2C(=O)C[NH+]3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)C[C@@H]2C(=O)NCCN2C(=O)C[NH+]3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C24H29N7O4/c1-17(32)18-3-5-19(6-4-18)28-21(33)15-20-23(35)25-9-10-31(20)22(34)16-29-11-13-30(14-12-29)24-26-7-2-8-27-24/h2-8,20H,9-16H2,1H3,(H,25,35)(H,28,33)/p+1/t20-/m1/s1