N-[2-(diethylamino)-5-morpholin-4-ylsulfonyl-phenyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[2-(diethylamino)-5-morpholin-4-ylsulfonyl-phenyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[2-(diethylamino)-5-morpholinosulfonyl-phenyl]acetamide CAS Name: N-[2-(diethylamino)-5-(4-morpholinylsulfonyl)phenyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[2-(diethylamino)-5-morpholin-4-ylsulfonylphenyl]acetamide Traditional Name: 2-(benzylthio)-N-[2-(diethylamino)-5-morpholinosulfonyl-phenyl]acetamide Formula: C23H31N3O4S2 MolecularWeight: 477.63994

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O4S2/c1-3-25(4-2)22-11-10-20(32(28,29)26-12-14-30-15-13-26)16-21(22)24-23(27)18-31-17-19-8-6-5-7-9-19/h5-11,16H,3-4,12-15,17-18H2,1-2H3,(H,24,27)