2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonylthiophen-2-yl)quinazoline dihydrochloride

Systemtic Name: 2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonylthiophen-2-yl)quinazoline dihydrochloride Openeye Name: 2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonyl-2-thienyl)quinazoline dihydrochloride CAS Name: 2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonyl-2-thiophenyl)quinazoline dihydrochloride IUPAC Name: 2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonylthiophen-2-yl)quinazoline dihydrochloride Traditional Name: 2-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-4-(5-mesyl-2-thienyl)quinazoline dihydrochloride Formula: C22H17Cl3N4O2S2 MolecularWeight: 539.88498

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(S1)C2=NC(=NC3=CC=CC=C32)C4=C(NN=C4)C5=CC=C(C=C5)Cl.Cl.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(S1)C2=NC(=NC3=CC=CC=C32)C4=C(NN=C4)C5=CC=C(C=C5)Cl.Cl.Cl

InChI

InChI=1S/C22H15ClN4O2S2.2ClH/c1-31(28,29)19-11-10-18(30-19)21-15-4-2-3-5-17(15)25-22(26-21)16-12-24-27-20(16)13-6-8-14(23)9-7-13;;/h2-12H,1H3,(H,24,27);2*1H