2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-(4-morpholinosulfonylphenyl)propionamide Formula: C22H29N3O6S2 MolecularWeight: 495.61216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)S(=O)(=O)C)C

InChI

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