quinoxalin-2-yl-[4-(4-thiophen-3-ylphenyl)sulfonylpiperidin-1-yl]methanone

Systemtic Name: quinoxalin-2-yl-[4-(4-thiophen-3-ylphenyl)sulfonylpiperidin-1-yl]methanone Openeye Name: quinoxalin-2-yl-[4-[4-(3-thienyl)phenyl]sulfonyl-1-piperidyl]methanone CAS Name: 2-quinoxalinyl-[4-[4-(3-thiophenyl)phenyl]sulfonyl-1-piperidinyl]methanone IUPAC Name: quinoxalin-2-yl-[4-(4-thiophen-3-ylphenyl)sulfonylpiperidin-1-yl]methanone Traditional Name: quinoxalin-2-yl-[4-[4-(3-thienyl)phenyl]sulfonylpiperidino]methanone Formula: C24H21N3O3S2 MolecularWeight: 463.57184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CSC=C3)C(=O)C4=NC5=CC=CC=C5N=C4

Isomeric SMILES

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CSC=C3)C(=O)C4=NC5=CC=CC=C5N=C4

InChI

InChI=1S/C24H21N3O3S2/c28-24(23-15-25-21-3-1-2-4-22(21)26-23)27-12-9-20(10-13-27)32(29,30)19-7-5-17(6-8-19)18-11-14-31-16-18/h1-8,11,14-16,20H,9-10,12-13H2