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

Systemtic Name: 6-azanyl-5-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 5-[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]-6-amino-1-benzyl-3-methyl-pyrimidine-2,4-dione CAS Name: 5-[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]-6-amino-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 5-[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]-6-amino-1-benzyl-3-methylpyrimidine-2,4-dione Traditional Name: 5-[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]-6-amino-1-benzyl-3-methyl-pyrimidine-2,4-quinone Formula: C20H26N5O4+ MolecularWeight: 400.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)C2=C(N(C(=O)N(C2=O)C)CC3=CC=CC=C3)N

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)C2=C(N(C(=O)N(C2=O)C)CC3=CC=CC=C3)N

InChI

InChI=1S/C20H25N5O4/c1-14(26)24-10-8-23(9-11-24)13-16(27)17-18(21)25(20(29)22(2)19(17)28)12-15-6-4-3-5-7-15/h3-7H,8-13,21H2,1-2H3/p+1