3-[[3-(4-chlorophenyl)-5-methyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[3-(4-chlorophenyl)-5-methyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[3-(4-chlorophenyl)-5-methyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[3-(4-chlorophenyl)-5-methyl-7-pyrazolo[1,5-a]pyrimidinyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[3-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[3-(4-chlorophenyl)-5-methyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-dimethyl-ammonium Formula: C18H23ClN5+ MolecularWeight: 344.86172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(=C1)NCCC[NH+](C)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC2=C(C=NN2C(=C1)NCCC[NH+](C)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H22ClN5/c1-13-11-17(20-9-4-10-23(2)3)24-18(22-13)16(12-21-24)14-5-7-15(19)8-6-14/h5-8,11-12,20H,4,9-10H2,1-3H3/p+1