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

Systemtic Name: 6-azanyl-5-[2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]ethanoyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(4-benzhydrylpiperazin-1-ium-1-yl)acetyl]-1-benzyl-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-(diphenylmethyl)-1-piperazin-1-iumyl]-1-oxoethyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(4-benzhydrylpiperazin-1-ium-1-yl)acetyl]-1-benzyl-3-methylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(4-benzhydrylpiperazin-1-ium-1-yl)acetyl]-1-benzyl-3-methyl-pyrimidine-2,4-quinone Formula: C31H34N5O3+ MolecularWeight: 524.63336

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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)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)C[NH+]3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H33N5O3/c1-33-30(38)27(29(32)36(31(33)39)21-23-11-5-2-6-12-23)26(37)22-34-17-19-35(20-18-34)28(24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,28H,17-22,32H2,1H3/p+1