2-[4-(3-methylphenyl)piperazin-1-yl]-6-(1H-pyrazol-4-yl)quinazoline hydrochloride

Systemtic Name: 2-[4-(3-methylphenyl)piperazin-1-yl]-6-(1H-pyrazol-4-yl)quinazoline hydrochloride Openeye Name: 2-[4-(m-tolyl)piperazin-1-yl]-6-(1H-pyrazol-4-yl)quinazoline hydrochloride CAS Name: 2-[4-(3-methylphenyl)-1-piperazinyl]-6-(1H-pyrazol-4-yl)quinazoline hydrochloride IUPAC Name: 2-[4-(3-methylphenyl)piperazin-1-yl]-6-(1H-pyrazol-4-yl)quinazoline hydrochloride Traditional Name: 2-[4-(m-tolyl)piperazino]-6-(1H-pyrazol-4-yl)quinazoline hydrochloride Formula: C22H23ClN6 MolecularWeight: 406.91122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C3=NC=C4C=C(C=CC4=N3)C5=CNN=C5.Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C3=NC=C4C=C(C=CC4=N3)C5=CNN=C5.Cl

InChI

InChI=1S/C22H22N6.ClH/c1-16-3-2-4-20(11-16)27-7-9-28(10-8-27)22-23-13-18-12-17(5-6-21(18)26-22)19-14-24-25-15-19;/h2-6,11-15H,7-10H2,1H3,(H,24,25);1H