6-(5-methyl-1H-pyrazol-4-yl)-2-[4-(3-methylsulfonylphenyl)piperazin-1-yl]quinazoline

Systemtic Name: 6-(5-methyl-1H-pyrazol-4-yl)-2-[4-(3-methylsulfonylphenyl)piperazin-1-yl]quinazoline Openeye Name: 6-(5-methyl-1H-pyrazol-4-yl)-2-[4-(3-methylsulfonylphenyl)piperazin-1-yl]quinazoline CAS Name: 6-(5-methyl-1H-pyrazol-4-yl)-2-[4-(3-methylsulfonylphenyl)-1-piperazinyl]quinazoline IUPAC Name: 6-(5-methyl-1H-pyrazol-4-yl)-2-[4-(3-methylsulfonylphenyl)piperazin-1-yl]quinazoline Traditional Name: 2-[4-(3-mesylphenyl)piperazino]-6-(5-methyl-1H-pyrazol-4-yl)quinazoline Formula: C23H24N6O2S MolecularWeight: 448.54066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C2=CC3=CN=C(N=C3C=C2)N4CCN(CC4)C5=CC(=CC=C5)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=NN1)C2=CC3=CN=C(N=C3C=C2)N4CCN(CC4)C5=CC(=CC=C5)S(=O)(=O)C

InChI

InChI=1S/C23H24N6O2S/c1-16-21(15-25-27-16)17-6-7-22-18(12-17)14-24-23(26-22)29-10-8-28(9-11-29)19-4-3-5-20(13-19)32(2,30)31/h3-7,12-15H,8-11H2,1-2H3,(H,25,27)