N-[1-(3,4-dimethylphenyl)ethyl]-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-(3-methylquinoxalin-2-yl)sulfanyl-acetamide CAS Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-[(3-methyl-2-quinoxalinyl)thio]acetamide IUPAC Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-(3-methylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-[(3-methylquinoxalin-2-yl)thio]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)NC(=O)CSC2=NC3=CC=CC=C3N=C2C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)NC(=O)CSC2=NC3=CC=CC=C3N=C2C)C

InChI

InChI=1S/C21H23N3OS/c1-13-9-10-17(11-14(13)2)15(3)23-20(25)12-26-21-16(4)22-18-7-5-6-8-19(18)24-21/h5-11,15H,12H2,1-4H3,(H,23,25)