6-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonylthiophen-2-yl)quinazoline dihydrochloride

Systemtic Name: 6-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonylthiophen-2-yl)quinazoline dihydrochloride Openeye Name: 6-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonyl-2-thienyl)quinazoline dihydrochloride CAS Name: 6-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonyl-2-thiophenyl)quinazoline dihydrochloride IUPAC Name: 6-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-4-(5-methylsulfonylthiophen-2-yl)quinazoline dihydrochloride Traditional Name: 6-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-4-(5-mesyl-2-thienyl)quinazoline dihydrochloride Formula: C24H22Cl2N4O4S2 MolecularWeight: 565.49188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=NN2)C3=CC4=C(C=C3)N=CN=C4C5=CC=C(S5)S(=O)(=O)C)OC.Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=NN2)C3=CC4=C(C=C3)N=CN=C4C5=CC=C(S5)S(=O)(=O)C)OC.Cl.Cl

InChI

InChI=1S/C24H20N4O4S2.2ClH/c1-31-19-7-5-15(11-20(19)32-2)23-17(12-27-28-23)14-4-6-18-16(10-14)24(26-13-25-18)21-8-9-22(33-21)34(3,29)30;;/h4-13H,1-3H3,(H,27,28);2*1H