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

Systemtic Name: 6-[3-(3,4-dimethoxyphenyl)-1-(triphenylmethyl)pyrazol-4-yl]-4-(5-methylsulfonylthiophen-2-yl)quinazoline Openeye Name: 6-[3-(3,4-dimethoxyphenyl)-1-trityl-pyrazol-4-yl]-4-(5-methylsulfonyl-2-thienyl)quinazoline CAS Name: 6-[3-(3,4-dimethoxyphenyl)-1-(triphenylmethyl)-4-pyrazolyl]-4-(5-methylsulfonyl-2-thiophenyl)quinazoline IUPAC Name: 6-[3-(3,4-dimethoxyphenyl)-1-tritylpyrazol-4-yl]-4-(5-methylsulfonylthiophen-2-yl)quinazoline Traditional Name: 6-[3-(3,4-dimethoxyphenyl)-1-trityl-pyrazol-4-yl]-4-(5-mesyl-2-thienyl)quinazoline Formula: C43H34N4O4S2 MolecularWeight: 734.88446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C3=CC4=C(C=C3)N=CN=C4C5=CC=C(S5)S(=O)(=O)C)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C3=CC4=C(C=C3)N=CN=C4C5=CC=C(S5)S(=O)(=O)C)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)OC

InChI

InChI=1S/C43H34N4O4S2/c1-50-37-22-20-30(26-38(37)51-2)41-35(29-19-21-36-34(25-29)42(45-28-44-36)39-23-24-40(52-39)53(3,48)49)27-47(46-41)43(31-13-7-4-8-14-31,32-15-9-5-10-16-32)33-17-11-6-12-18-33/h4-28H,1-3H3