[4-(4-pyrimidin-5-ylphenyl)sulfonylpiperidin-1-yl]-quinoxalin-2-yl-methanone

Systemtic Name: [4-(4-pyrimidin-5-ylphenyl)sulfonylpiperidin-1-yl]-quinoxalin-2-yl-methanone Openeye Name: [4-(4-pyrimidin-5-ylphenyl)sulfonyl-1-piperidyl]-quinoxalin-2-yl-methanone CAS Name: [4-[4-(5-pyrimidinyl)phenyl]sulfonyl-1-piperidinyl]-(2-quinoxalinyl)methanone IUPAC Name: [4-(4-pyrimidin-5-ylphenyl)sulfonylpiperidin-1-yl]-quinoxalin-2-ylmethanone Traditional Name: [4-[4-(5-pyrimidyl)phenyl]sulfonylpiperidino]-quinoxalin-2-yl-methanone Formula: C24H21N5O3S MolecularWeight: 459.52024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N5O3S/c30-24(23-15-27-21-3-1-2-4-22(21)28-23)29-11-9-20(10-12-29)33(31,32)19-7-5-17(6-8-19)18-13-25-16-26-14-18/h1-8,13-16,20H,9-12H2