2-ethyl-5-methyl-7-[4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]-3-phenyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-ethyl-5-methyl-7-[4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]-3-phenyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 2-ethyl-5-methyl-7-[4-(2-methylallyl)piperazin-4-ium-1-yl]-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 2-ethyl-5-methyl-7-[4-(2-methylprop-2-enyl)-1-piperazin-4-iumyl]-3-phenylpyrazolo[1,5-a]pyrimidine IUPAC Name: 2-ethyl-5-methyl-7-[4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 2-ethyl-5-methyl-7-[4-(2-methylallyl)piperazin-4-ium-1-yl]-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C23H30N5+ MolecularWeight: 376.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C)N4CC[NH+](CC4)CC(=C)C

Isomeric SMILES

CCC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C)N4CC[NH+](CC4)CC(=C)C

InChI

InChI=1S/C23H29N5/c1-5-20-22(19-9-7-6-8-10-19)23-24-18(4)15-21(28(23)25-20)27-13-11-26(12-14-27)16-17(2)3/h6-10,15H,2,5,11-14,16H2,1,3-4H3/p+1