2,4-dimethyl-3-[3-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]imidazo[1,5-a]pyrimidine-8-carboxamide

Systemtic Name: 2,4-dimethyl-3-[3-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]imidazo[1,5-a]pyrimidine-8-carboxamide Openeye Name: 2,4-dimethyl-3-[3-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-3-oxo-propyl]imidazo[1,5-a]pyrimidine-8-carboxamide CAS Name: 2,4-dimethyl-3-[3-[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]-3-oxopropyl]-8-imidazo[1,5-a]pyrimidinecarboxamide IUPAC Name: 2,4-dimethyl-3-[3-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-yl]-3-oxopropyl]imidazo[1,5-a]pyrimidine-8-carboxamide Traditional Name: 3-[3-keto-3-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2,4-dimethyl-imidazo[1,5-a]pyrimidine-8-carboxamide Formula: C23H29N6O2+ MolecularWeight: 421.51536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C(N=CN12)C(=O)N)C)CCC(=O)N3CC[NH+](CC3C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=NC2=C(N=CN12)C(=O)N)C)CCC(=O)N3CC[NH+](C[C@H]3C4=CC=CC=C4)C

InChI

InChI=1S/C23H28N6O2/c1-15-18(16(2)29-14-25-21(22(24)31)23(29)26-15)9-10-20(30)28-12-11-27(3)13-19(28)17-7-5-4-6-8-17/h4-8,14,19H,9-13H2,1-3H3,(H2,24,31)/p+1/t19-/m0/s1