2-[3-[(4-chlorophenyl)methyl]quinoxalin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[3-[(4-chlorophenyl)methyl]quinoxalin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[3-[(4-chlorophenyl)methyl]quinoxalin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)acetamide CAS Name: 2-[[3-[(4-chlorophenyl)methyl]-2-quinoxalinyl]thio]-N-(3,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[3-[(4-chlorophenyl)methyl]quinoxalin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)acetamide Traditional Name: 2-[[3-(4-chlorobenzyl)quinoxalin-2-yl]thio]-N-(3,5-dimethoxyphenyl)acetamide Formula: C25H22ClN3O3S MolecularWeight: 479.97848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=C(C=C4)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C25H22ClN3O3S/c1-31-19-12-18(13-20(14-19)32-2)27-24(30)15-33-25-23(11-16-7-9-17(26)10-8-16)28-21-5-3-4-6-22(21)29-25/h3-10,12-14H,11,15H2,1-2H3,(H,27,30)