3-methyl-2-[2-morpholin-4-ylethyl-(4-phenylsulfanylphenyl)sulfonyl-amino]-N-(oxan-2-yloxy)butanamide

Systemtic Name: 3-methyl-2-[2-morpholin-4-ylethyl-(4-phenylsulfanylphenyl)sulfonyl-amino]-N-(oxan-2-yloxy)butanamide Openeye Name: 3-methyl-2-[2-morpholinoethyl-(4-phenylsulfanylphenyl)sulfonyl-amino]-N-tetrahydropyran-2-yloxy-butanamide CAS Name: 3-methyl-2-[2-(4-morpholinyl)ethyl-[4-(phenylthio)phenyl]sulfonylamino]-N-(2-oxanyloxy)butanamide IUPAC Name: 3-methyl-2-[2-morpholin-4-ylethyl-(4-phenylsulfanylphenyl)sulfonylamino]-N-(oxan-2-yloxy)butanamide Traditional Name: 3-methyl-2-[2-morpholinoethyl-[4-(phenylthio)phenyl]sulfonyl-amino]-N-tetrahydropyran-2-yloxy-butyramide Formula: C28H39N3O6S2 MolecularWeight: 577.75576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NOC1CCCCO1)N(CCN2CCOCC2)S(=O)(=O)C3=CC=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

CC(C)C(C(=O)NOC1CCCCO1)N(CCN2CCOCC2)S(=O)(=O)C3=CC=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O6S2/c1-22(2)27(28(32)29-37-26-10-6-7-19-36-26)31(16-15-30-17-20-35-21-18-30)39(33,34)25-13-11-24(12-14-25)38-23-8-4-3-5-9-23/h3-5,8-9,11-14,22,26-27H,6-7,10,15-21H2,1-2H3,(H,29,32)