1,3-dimethyl-5-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-6-propan-2-yl-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 1,3-dimethyl-5-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-6-propan-2-yl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-isopropyl-1,3-dimethyl-5-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1,3-dimethyl-5-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-6-propan-2-yl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 1,3-dimethyl-5-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-6-propan-2-ylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-isopropyl-1,3-dimethyl-5-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]pyrazolo[4,3-d]pyrimidin-7-one Formula: C22H31N6O+ MolecularWeight: 395.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C3=NC4=C(C(=O)N3C(C)C)N(N=C4C)C

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C3=NC4=C(C(=O)N3C(C)C)N(N=C4C)C

InChI

InChI=1S/C22H30N6O/c1-15(2)28-21(29)20-19(17(4)24-25(20)5)23-22(28)27-12-10-26(11-13-27)14-18-9-7-6-8-16(18)3/h6-9,15H,10-14H2,1-5H3/p+1