4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-(2-morpholin-4-ylcarbonylphenyl)butanamide

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-(2-morpholin-4-ylcarbonylphenyl)butanamide Openeye Name: 4-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[2-(morpholine-4-carbonyl)phenyl]butanamide CAS Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[2-[4-morpholinyl(oxo)methyl]phenyl]butanamide IUPAC Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[2-(morpholine-4-carbonyl)phenyl]butanamide Traditional Name: 4-(5-chloro-N-mesyl-2-methyl-anilino)-N-[2-(morpholine-4-carbonyl)phenyl]butyramide Formula: C23H28ClN3O5S MolecularWeight: 494.00352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NC2=CC=CC=C2C(=O)N3CCOCC3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NC2=CC=CC=C2C(=O)N3CCOCC3)S(=O)(=O)C

InChI

InChI=1S/C23H28ClN3O5S/c1-17-9-10-18(24)16-21(17)27(33(2,30)31)11-5-8-22(28)25-20-7-4-3-6-19(20)23(29)26-12-14-32-15-13-26/h3-4,6-7,9-10,16H,5,8,11-15H2,1-2H3,(H,25,28)