N-(2-ethylsulfanylphenyl)-2-[methylsulfonyl-(4-morpholin-4-ylsulfonylphenyl)amino]ethanamide

Systemtic Name: N-(2-ethylsulfanylphenyl)-2-[methylsulfonyl-(4-morpholin-4-ylsulfonylphenyl)amino]ethanamide Openeye Name: N-(2-ethylsulfanylphenyl)-2-(N-methylsulfonyl-4-morpholinosulfonyl-anilino)acetamide CAS Name: N-[2-(ethylthio)phenyl]-2-[N-methylsulfonyl-4-(4-morpholinylsulfonyl)anilino]acetamide IUPAC Name: N-(2-ethylsulfanylphenyl)-2-(N-methylsulfonyl-4-morpholin-4-ylsulfonylanilino)acetamide Traditional Name: N-[2-(ethylthio)phenyl]-2-(N-mesyl-4-morpholinosulfonyl-anilino)acetamide Formula: C21H27N3O6S3 MolecularWeight: 513.65058

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)CN(C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)S(=O)(=O)C

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)CN(C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O6S3/c1-3-31-20-7-5-4-6-19(20)22-21(25)16-24(32(2,26)27)17-8-10-18(11-9-17)33(28,29)23-12-14-30-15-13-23/h4-11H,3,12-16H2,1-2H3,(H,22,25)