N-(2,4-dimethylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,4-dimethylphenyl)-2-(3-morpholinoquinoxalin-2-yl)sulfanyl-acetamide CAS Name: N-(2,4-dimethylphenyl)-2-[[3-(4-morpholinyl)-2-quinoxalinyl]thio]acetamide IUPAC Name: N-(2,4-dimethylphenyl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-(2,4-dimethylphenyl)-2-[(3-morpholinoquinoxalin-2-yl)thio]acetamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2N4CCOCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2N4CCOCC4)C

InChI

InChI=1S/C22H24N4O2S/c1-15-7-8-17(16(2)13-15)23-20(27)14-29-22-21(26-9-11-28-12-10-26)24-18-5-3-4-6-19(18)25-22/h3-8,13H,9-12,14H2,1-2H3,(H,23,27)