N-(3-methylphenyl)-2-[3-[(3-nitrophenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[3-[(3-nitrophenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanamide Openeye Name: N-(m-tolyl)-2-[3-[(3-nitrophenyl)methyl]quinoxalin-2-yl]sulfanyl-acetamide CAS Name: N-(3-methylphenyl)-2-[[3-[(3-nitrophenyl)methyl]-2-quinoxalinyl]thio]acetamide IUPAC Name: N-(3-methylphenyl)-2-[3-[(3-nitrophenyl)methyl]quinoxalin-2-yl]sulfanylacetamide Traditional Name: N-(m-tolyl)-2-[[3-(3-nitrobenzyl)quinoxalin-2-yl]thio]acetamide Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O3S/c1-16-6-4-8-18(12-16)25-23(29)15-32-24-22(26-20-10-2-3-11-21(20)27-24)14-17-7-5-9-19(13-17)28(30)31/h2-13H,14-15H2,1H3,(H,25,29)