4-(4-fluorophenyl)-6-[5-(4-methylsulfanylphenyl)-1H-pyrazol-4-yl]quinazoline dihydrochloride

Systemtic Name: 4-(4-fluorophenyl)-6-[5-(4-methylsulfanylphenyl)-1H-pyrazol-4-yl]quinazoline dihydrochloride Openeye Name: 4-(4-fluorophenyl)-6-[5-(4-methylsulfanylphenyl)-1H-pyrazol-4-yl]quinazoline dihydrochloride CAS Name: 4-(4-fluorophenyl)-6-[5-[4-(methylthio)phenyl]-1H-pyrazol-4-yl]quinazoline dihydrochloride IUPAC Name: 4-(4-fluorophenyl)-6-[5-(4-methylsulfanylphenyl)-1H-pyrazol-4-yl]quinazoline dihydrochloride Traditional Name: 4-(4-fluorophenyl)-6-[5-[4-(methylthio)phenyl]-1H-pyrazol-4-yl]quinazoline dihydrochloride Formula: C24H19Cl2FN4S MolecularWeight: 485.403863

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C=NN2)C3=CC4=C(C=C3)N=CN=C4C5=CC=C(C=C5)F.Cl.Cl

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C=NN2)C3=CC4=C(C=C3)N=CN=C4C5=CC=C(C=C5)F.Cl.Cl

InChI

InChI=1S/C24H17FN4S.2ClH/c1-30-19-9-4-16(5-10-19)24-21(13-28-29-24)17-6-11-22-20(12-17)23(27-14-26-22)15-2-7-18(25)8-3-15;;/h2-14H,1H3,(H,28,29);2*1H