2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[(2-morpholin-4-ylpyridin-3-yl)methyl]butanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[(2-morpholin-4-ylpyridin-3-yl)methyl]butanamide Openeye Name: 4-methylsulfanyl-N-[(2-morpholino-3-pyridyl)methyl]-2-(p-tolylsulfonylamino)butanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-N-[[2-(4-morpholinyl)-3-pyridinyl]methyl]butanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[(2-morpholin-4-ylpyridin-3-yl)methyl]butanamide Traditional Name: 4-(methylthio)-N-[(2-morpholino-3-pyridyl)methyl]-2-(tosylamino)butyramide Formula: C22H30N4O4S2 MolecularWeight: 478.628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC2=C(N=CC=C2)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC2=C(N=CC=C2)N3CCOCC3

InChI

InChI=1S/C22H30N4O4S2/c1-17-5-7-19(8-6-17)32(28,29)25-20(9-15-31-2)22(27)24-16-18-4-3-10-23-21(18)26-11-13-30-14-12-26/h3-8,10,20,25H,9,11-16H2,1-2H3,(H,24,27)