4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]-N-(4-morpholin-4-ylsulfonylphenyl)benzamide

Systemtic Name: 4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]-N-(4-morpholin-4-ylsulfonylphenyl)benzamide Openeye Name: 4-[(3-methyl-N-methylsulfonyl-anilino)methyl]-N-(4-morpholinosulfonylphenyl)benzamide CAS Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-[4-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)benzamide Traditional Name: 4-[(N-mesyl-3-methyl-anilino)methyl]-N-(4-morpholinosulfonylphenyl)benzamide Formula: C26H29N3O6S2 MolecularWeight: 543.65496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)S(=O)(=O)C

InChI

InChI=1S/C26H29N3O6S2/c1-20-4-3-5-24(18-20)29(36(2,31)32)19-21-6-8-22(9-7-21)26(30)27-23-10-12-25(13-11-23)37(33,34)28-14-16-35-17-15-28/h3-13,18H,14-17,19H2,1-2H3,(H,27,30)