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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=NN2C(=C1)N3CC[NH+](CC3)CC(=C)C)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NC2=C(C=NN2C(=C1)N3CC[NH+](CC3)CC(=C)C)C4=CC=CC=C4

InChI

InChI=1S/C23H29N5/c1-4-8-20-15-22(27-13-11-26(12-14-27)17-18(2)3)28-23(25-20)21(16-24-28)19-9-6-5-7-10-19/h5-7,9-10,15-16H,2,4,8,11-14,17H2,1,3H3/p+1