ethyl 4-[[2-[(2-methylphenyl)methylsulfanylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxalin-6-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[(2-methylphenyl)methylsulfanylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxalin-6-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(o-tolylmethylsulfanylmethyl)-3-oxo-2,4-dihydro-1H-quinoxaline-6-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[2-[[(2-methylphenyl)methylthio]methyl]-3-oxo-2,4-dihydro-1H-quinoxalin-6-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2-methylphenyl)methylsulfanylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-keto-2-[[(2-methylbenzyl)thio]methyl]-2,4-dihydro-1H-quinoxaline-6-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CSCC4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CSCC4=CC=CC=C4C

InChI

InChI=1S/C26H32N4O4S/c1-3-34-26(33)30-12-10-20(11-13-30)27-24(31)18-8-9-21-22(14-18)29-25(32)23(28-21)16-35-15-19-7-5-4-6-17(19)2/h4-9,14,20,23,28H,3,10-13,15-16H2,1-2H3,(H,27,31)(H,29,32)