2-[(4-methylphenyl)-methylsulfonyl-amino]-N-(4-morpholin-4-ylsulfonylphenyl)butanamide

Systemtic Name: 2-[(4-methylphenyl)-methylsulfonyl-amino]-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)-N-(4-morpholinosulfonylphenyl)butanamide CAS Name: 2-(4-methyl-N-methylsulfonylanilino)-N-[4-(4-morpholinylsulfonyl)phenyl]butanamide IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Traditional Name: 2-(N-mesyl-4-methyl-anilino)-N-(4-morpholinosulfonylphenyl)butyramide Formula: C22H29N3O6S2 MolecularWeight: 495.61216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N(C3=CC=C(C=C3)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N(C3=CC=C(C=C3)C)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O6S2/c1-4-21(25(32(3,27)28)19-9-5-17(2)6-10-19)22(26)23-18-7-11-20(12-8-18)33(29,30)24-13-15-31-16-14-24/h5-12,21H,4,13-16H2,1-3H3,(H,23,26)