[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-[4-methoxy-3-(2-pyridin-2-ylethynyl)phenyl]methanone

Systemtic Name: [4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-[4-methoxy-3-(2-pyridin-2-ylethynyl)phenyl]methanone Openeye Name: [4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-[4-methoxy-3-[2-(2-pyridyl)ethynyl]phenyl]methanone CAS Name: [4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-[4-methoxy-3-[2-(2-pyridinyl)ethynyl]phenyl]methanone IUPAC Name: [4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-[4-methoxy-3-(2-pyridin-2-ylethynyl)phenyl]methanone Traditional Name: [4-(2-chlorophenyl)sulfonylpiperazino]-[4-methoxy-3-[2-(2-pyridyl)ethynyl]phenyl]methanone Formula: C25H22ClN3O4S MolecularWeight: 495.97788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl)C#CC4=CC=CC=N4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl)C#CC4=CC=CC=N4

InChI

InChI=1S/C25H22ClN3O4S/c1-33-23-12-10-20(18-19(23)9-11-21-6-4-5-13-27-21)25(30)28-14-16-29(17-15-28)34(31,32)24-8-3-2-7-22(24)26/h2-8,10,12-13,18H,14-17H2,1H3