N-(2-chloranyl-4-methyl-phenyl)-2-[3-(phenylmethyl)quinoxalin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-2-[3-(phenylmethyl)quinoxalin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzylquinoxalin-2-yl)sulfanyl-N-(2-chloro-4-methyl-phenyl)acetamide CAS Name: N-(2-chloro-4-methylphenyl)-2-[[3-(phenylmethyl)-2-quinoxalinyl]thio]acetamide IUPAC Name: 2-(3-benzylquinoxalin-2-yl)sulfanyl-N-(2-chloro-4-methylphenyl)acetamide Traditional Name: 2-[(3-benzylquinoxalin-2-yl)thio]-N-(2-chloro-4-methyl-phenyl)acetamide Formula: C24H20ClN3OS MolecularWeight: 433.9531

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H20ClN3OS/c1-16-11-12-19(18(25)13-16)27-23(29)15-30-24-22(14-17-7-3-2-4-8-17)26-20-9-5-6-10-21(20)28-24/h2-13H,14-15H2,1H3,(H,27,29)