3-(4-chlorophenyl)-2,5-dimethyl-7-(4-propylpiperazin-4-ium-1-yl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 3-(4-chlorophenyl)-2,5-dimethyl-7-(4-propylpiperazin-4-ium-1-yl)pyrazolo[1,5-a]pyrimidine Openeye Name: 3-(4-chlorophenyl)-2,5-dimethyl-7-(4-propylpiperazin-4-ium-1-yl)pyrazolo[1,5-a]pyrimidine CAS Name: 3-(4-chlorophenyl)-2,5-dimethyl-7-(4-propyl-1-piperazin-4-iumyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 3-(4-chlorophenyl)-2,5-dimethyl-7-(4-propylpiperazin-4-ium-1-yl)pyrazolo[1,5-a]pyrimidine Traditional Name: 3-(4-chlorophenyl)-2,5-dimethyl-7-(4-propylpiperazin-4-ium-1-yl)pyrazolo[1,5-a]pyrimidine Formula: C21H27ClN5+ MolecularWeight: 384.92558

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C2=CC(=NC3=C(C(=NN23)C)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCC[NH+]1CCN(CC1)C2=CC(=NC3=C(C(=NN23)C)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C21H26ClN5/c1-4-9-25-10-12-26(13-11-25)19-14-15(2)23-21-20(16(3)24-27(19)21)17-5-7-18(22)8-6-17/h5-8,14H,4,9-13H2,1-3H3/p+1