6-azanyl-3-methyl-5-[2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-ium-1-yl]ethanoyl]-1-(2-methylpropyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-5-[2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-ium-1-yl]ethanoyl]-1-(2-methylpropyl)pyrimidine-2,4-dione Openeye Name: 6-amino-1-isobutyl-3-methyl-5-[2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-ium-1-yl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-5-[2-[4-(2-methyl-1-oxo-2-phenylpropyl)-1-piperazin-1-iumyl]-1-oxoethyl]-1-(2-methylpropyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-3-methyl-5-[2-[4-(2-methyl-2-phenylpropanoyl)piperazin-1-ium-1-yl]acetyl]-1-(2-methylpropyl)pyrimidine-2,4-dione Traditional Name: 6-amino-1-isobutyl-3-methyl-5-[2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-ium-1-yl]acetyl]pyrimidine-2,4-quinone Formula: C25H36N5O4+ MolecularWeight: 470.58444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35N5O4/c1-17(2)15-30-21(26)20(22(32)27(5)24(30)34)19(31)16-28-11-13-29(14-12-28)23(33)25(3,4)18-9-7-6-8-10-18/h6-10,17H,11-16,26H2,1-5H3/p+1