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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C3=NC=NC4=C3C=C(C=C4)C5=CNN=C5.Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C3=NC=NC4=C3C=C(C=C4)C5=CNN=C5.Cl

InChI

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