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

Systemtic Name: N-(2-ethylsulfanylphenyl)-2-[methylsulfonyl-(4-morpholin-4-ylcarbonylphenyl)amino]ethanamide Openeye Name: N-(2-ethylsulfanylphenyl)-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide CAS Name: N-[2-(ethylthio)phenyl]-2-[N-methylsulfonyl-4-[4-morpholinyl(oxo)methyl]anilino]acetamide IUPAC Name: N-(2-ethylsulfanylphenyl)-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide Traditional Name: N-[2-(ethylthio)phenyl]-2-[N-mesyl-4-(morpholine-4-carbonyl)anilino]acetamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S2/c1-3-31-20-7-5-4-6-19(20)23-21(26)16-25(32(2,28)29)18-10-8-17(9-11-18)22(27)24-12-14-30-15-13-24/h4-11H,3,12-16H2,1-2H3,(H,23,26)