6-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-[4-(3-methylsulfonylphenyl)piperazin-1-yl]quinazoline

Systemtic Name: 6-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-[4-(3-methylsulfonylphenyl)piperazin-1-yl]quinazoline Openeye Name: 6-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-[4-(3-methylsulfonylphenyl)piperazin-1-yl]quinazoline CAS Name: 6-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-[4-(3-methylsulfonylphenyl)-1-piperazinyl]quinazoline IUPAC Name: 6-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-[4-(3-methylsulfonylphenyl)piperazin-1-yl]quinazoline Traditional Name: 6-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-[4-(3-mesylphenyl)piperazino]quinazoline Formula: C28H25ClN6O2S MolecularWeight: 545.0551

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)N2CCN(CC2)C3=NC=NC4=C3C=C(C=C4)C5=C(NN=C5)C6=CC=C(C=C6)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)N2CCN(CC2)C3=NC=NC4=C3C=C(C=C4)C5=C(NN=C5)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C28H25ClN6O2S/c1-38(36,37)23-4-2-3-22(16-23)34-11-13-35(14-12-34)28-24-15-20(7-10-26(24)30-18-31-28)25-17-32-33-27(25)19-5-8-21(29)9-6-19/h2-10,15-18H,11-14H2,1H3,(H,32,33)