4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(3-morpholin-4-ylpropyl)butanamide

Systemtic Name: 4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(3-morpholin-4-ylpropyl)butanamide Openeye Name: 4-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-(3-morpholinopropyl)butanamide CAS Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-morpholinyl)propyl]butanamide IUPAC Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-(3-morpholin-4-ylpropyl)butanamide Traditional Name: 4-(N-mesyl-2,5-dimethyl-anilino)-N-(3-morpholinopropyl)butyramide Formula: C20H33N3O4S MolecularWeight: 411.55872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CCCC(=O)NCCCN2CCOCC2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CCCC(=O)NCCCN2CCOCC2)S(=O)(=O)C

InChI

InChI=1S/C20H33N3O4S/c1-17-7-8-18(2)19(16-17)23(28(3,25)26)11-4-6-20(24)21-9-5-10-22-12-14-27-15-13-22/h7-8,16H,4-6,9-15H2,1-3H3,(H,21,24)