4-(4-methylpiperazin-4-ium-1-yl)-6-(1-methylpyrazol-4-yl)quinazoline

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-6-(1-methylpyrazol-4-yl)quinazoline Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-6-(1-methylpyrazol-4-yl)quinazoline CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-6-(1-methyl-4-pyrazolyl)quinazoline IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-6-(1-methylpyrazol-4-yl)quinazoline Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-6-(1-methylpyrazol-4-yl)quinazoline Formula: C17H21N6+ MolecularWeight: 309.38884

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=NC3=C2C=C(C=C3)C4=CN(N=C4)C

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=NC3=C2C=C(C=C3)C4=CN(N=C4)C

InChI

InChI=1S/C17H20N6/c1-21-5-7-23(8-6-21)17-15-9-13(14-10-20-22(2)11-14)3-4-16(15)18-12-19-17/h3-4,9-12H,5-8H2,1-2H3/p+1