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

Systemtic Name: 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-6-pyrazol-1-yl-quinazoline hydrochloride Openeye Name: 2-[4-(p-tolylmethyl)piperazin-1-yl]-6-pyrazol-1-yl-quinazoline hydrochloride CAS Name: 2-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-6-(1-pyrazolyl)quinazoline hydrochloride IUPAC Name: 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-6-pyrazol-1-ylquinazoline hydrochloride Traditional Name: 2-[4-(4-methylbenzyl)piperazino]-6-pyrazol-1-yl-quinazoline hydrochloride Formula: C23H25ClN6 MolecularWeight: 420.9378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC=C4C=C(C=CC4=N3)N5C=CC=N5.Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC=C4C=C(C=CC4=N3)N5C=CC=N5.Cl

InChI

InChI=1S/C23H24N6.ClH/c1-18-3-5-19(6-4-18)17-27-11-13-28(14-12-27)23-24-16-20-15-21(7-8-22(20)26-23)29-10-2-9-25-29;/h2-10,15-16H,11-14,17H2,1H3;1H