2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanyl-1-(2-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanyl-1-(2-methylpiperidin-1-yl)ethanone Openeye Name: 1-(2-methyl-1-piperidyl)-2-[3-(p-tolylmethyl)quinoxalin-2-yl]sulfanyl-ethanone CAS Name: 2-[[3-[(4-methylphenyl)methyl]-2-quinoxalinyl]thio]-1-(2-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanyl-1-(2-methylpiperidin-1-yl)ethanone Traditional Name: 2-[[3-(4-methylbenzyl)quinoxalin-2-yl]thio]-1-(2-methylpiperidino)ethanone Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=C(C=C4)C

Isomeric SMILES

CC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=C(C=C4)C

InChI

InChI=1S/C24H27N3OS/c1-17-10-12-19(13-11-17)15-22-24(26-21-9-4-3-8-20(21)25-22)29-16-23(28)27-14-6-5-7-18(27)2/h3-4,8-13,18H,5-7,14-16H2,1-2H3