2-methylsulfanyl-N-(4-morpholin-4-yl-3-morpholin-4-ylsulfonyl-phenyl)benzamide

Systemtic Name: 2-methylsulfanyl-N-(4-morpholin-4-yl-3-morpholin-4-ylsulfonyl-phenyl)benzamide Openeye Name: 2-methylsulfanyl-N-(4-morpholino-3-morpholinosulfonyl-phenyl)benzamide CAS Name: 2-(methylthio)-N-[4-(4-morpholinyl)-3-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 2-methylsulfanyl-N-(4-morpholin-4-yl-3-morpholin-4-ylsulfonylphenyl)benzamide Traditional Name: 2-(methylthio)-N-(4-morpholino-3-morpholinosulfonyl-phenyl)benzamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)N3CCOCC3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)N3CCOCC3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H27N3O5S2/c1-31-20-5-3-2-4-18(20)22(26)23-17-6-7-19(24-8-12-29-13-9-24)21(16-17)32(27,28)25-10-14-30-15-11-25/h2-7,16H,8-15H2,1H3,(H,23,26)