3-[4-[4-(5-methylsulfonylthiophen-2-yl)quinazolin-6-yl]-1H-pyrazol-5-yl]benzenecarbonitrile

Systemtic Name: 3-[4-[4-(5-methylsulfonylthiophen-2-yl)quinazolin-6-yl]-1H-pyrazol-5-yl]benzenecarbonitrile Openeye Name: 3-[4-[4-(5-methylsulfonyl-2-thienyl)quinazolin-6-yl]-1H-pyrazol-5-yl]benzonitrile CAS Name: 3-[4-[4-(5-methylsulfonyl-2-thiophenyl)-6-quinazolinyl]-1H-pyrazol-5-yl]benzonitrile IUPAC Name: 3-[4-[4-(5-methylsulfonylthiophen-2-yl)quinazolin-6-yl]-1H-pyrazol-5-yl]benzonitrile Traditional Name: 3-[4-[4-(5-mesyl-2-thienyl)quinazolin-6-yl]-1H-pyrazol-5-yl]benzonitrile Formula: C23H15N5O2S2 MolecularWeight: 457.5275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(S1)C2=NC=NC3=C2C=C(C=C3)C4=C(NN=C4)C5=CC=CC(=C5)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(S1)C2=NC=NC3=C2C=C(C=C3)C4=C(NN=C4)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C23H15N5O2S2/c1-32(29,30)21-8-7-20(31-21)23-17-10-15(5-6-19(17)25-13-26-23)18-12-27-28-22(18)16-4-2-3-14(9-16)11-24/h2-10,12-13H,1H3,(H,27,28)