N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-quinoxalin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-quinoxalin-2-ylsulfanyl-ethanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-quinoxalin-2-ylsulfanyl-acetamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-(2-quinoxalinylthio)acetamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-quinoxalin-2-ylsulfanylacetamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-(quinoxalin-2-ylthio)acetamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H22N4O4S2/c1-15-6-7-16(12-19(15)31(27,28)25-8-10-29-11-9-25)23-20(26)14-30-21-13-22-17-4-2-3-5-18(17)24-21/h2-7,12-13H,8-11,14H2,1H3,(H,23,26)