N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-propanamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[(3-methyl-2-quinoxalinyl)thio]propanamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-(3-methylquinoxalin-2-yl)sulfanylpropanamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[(3-methylquinoxalin-2-yl)thio]propionamide Formula: C23H26N4O4S2 MolecularWeight: 486.60694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3N=C2C)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3N=C2C)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H26N4O4S2/c1-15-8-9-18(14-21(15)33(29,30)27-10-12-31-13-11-27)25-22(28)17(3)32-23-16(2)24-19-6-4-5-7-20(19)26-23/h4-9,14,17H,10-13H2,1-3H3,(H,25,28)