N-(4-methylphenyl)-2-(6-piperidin-1-ylsulfonylquinoxalin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-methylphenyl)-2-(6-piperidin-1-ylsulfonylquinoxalin-2-yl)sulfanyl-ethanamide Openeye Name: 2-[6-(1-piperidylsulfonyl)quinoxalin-2-yl]sulfanyl-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[[6-(1-piperidinylsulfonyl)-2-quinoxalinyl]thio]acetamide IUPAC Name: N-(4-methylphenyl)-2-(6-piperidin-1-ylsulfonylquinoxalin-2-yl)sulfanylacetamide Traditional Name: 2-[(6-piperidinosulfonylquinoxalin-2-yl)thio]-N-(p-tolyl)acetamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=CN=C3C=C(C=CC3=N2)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=CN=C3C=C(C=CC3=N2)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H24N4O3S2/c1-16-5-7-17(8-6-16)24-21(27)15-30-22-14-23-20-13-18(9-10-19(20)25-22)31(28,29)26-11-3-2-4-12-26/h5-10,13-14H,2-4,11-12,15H2,1H3,(H,24,27)