6-(5-methyl-1H-pyrazol-4-yl)-5-methylsulfonyl-4-thiophen-2-yl-quinazoline dihydrochloride

Systemtic Name: 6-(5-methyl-1H-pyrazol-4-yl)-5-methylsulfonyl-4-thiophen-2-yl-quinazoline dihydrochloride Openeye Name: 6-(5-methyl-1H-pyrazol-4-yl)-5-methylsulfonyl-4-(2-thienyl)quinazoline dihydrochloride CAS Name: 6-(5-methyl-1H-pyrazol-4-yl)-5-methylsulfonyl-4-thiophen-2-ylquinazoline dihydrochloride IUPAC Name: 6-(5-methyl-1H-pyrazol-4-yl)-5-methylsulfonyl-4-thiophen-2-ylquinazoline dihydrochloride Traditional Name: 5-mesyl-6-(5-methyl-1H-pyrazol-4-yl)-4-(2-thienyl)quinazoline dihydrochloride Formula: C17H16Cl2N4O2S2 MolecularWeight: 443.37054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C2=C(C3=C(C=C2)N=CN=C3C4=CC=CS4)S(=O)(=O)C.Cl.Cl

Isomeric SMILES

CC1=C(C=NN1)C2=C(C3=C(C=C2)N=CN=C3C4=CC=CS4)S(=O)(=O)C.Cl.Cl

InChI

InChI=1S/C17H14N4O2S2.2ClH/c1-10-12(8-20-21-10)11-5-6-13-15(17(11)25(2,22)23)16(19-9-18-13)14-4-3-7-24-14;;/h3-9H,1-2H3,(H,20,21);2*1H