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

Systemtic Name: 3-methyl-2-[[4-(3-methylphenyl)sulfanylphenyl]sulfonyl-(2-morpholin-4-ylethyl)amino]-N-(oxan-2-yloxy)butanamide Openeye Name: 3-methyl-2-[2-morpholinoethyl-[4-(m-tolylsulfanyl)phenyl]sulfonyl-amino]-N-tetrahydropyran-2-yloxy-butanamide CAS Name: 3-methyl-2-[[4-[(3-methylphenyl)thio]phenyl]sulfonyl-[2-(4-morpholinyl)ethyl]amino]-N-(2-oxanyloxy)butanamide IUPAC Name: 3-methyl-2-[[4-(3-methylphenyl)sulfanylphenyl]sulfonyl-(2-morpholin-4-ylethyl)amino]-N-(oxan-2-yloxy)butanamide Traditional Name: 3-methyl-2-[2-morpholinoethyl-[4-(m-tolylthio)phenyl]sulfonyl-amino]-N-tetrahydropyran-2-yloxy-butyramide Formula: C29H41N3O6S2 MolecularWeight: 591.78234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC2=CC=C(C=C2)S(=O)(=O)N(CCN3CCOCC3)C(C(C)C)C(=O)NOC4CCCCO4

Isomeric SMILES

CC1=CC(=CC=C1)SC2=CC=C(C=C2)S(=O)(=O)N(CCN3CCOCC3)C(C(C)C)C(=O)NOC4CCCCO4

InChI

InChI=1S/C29H41N3O6S2/c1-22(2)28(29(33)30-38-27-9-4-5-18-37-27)32(15-14-31-16-19-36-20-17-31)40(34,35)26-12-10-24(11-13-26)39-25-8-6-7-23(3)21-25/h6-8,10-13,21-22,27-28H,4-5,9,14-20H2,1-3H3,(H,30,33)