4-[[(3,4-dimethyl-2-methylsulfonyl-phenyl)amino]methyl]-N-(4-piperidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 4-[[(3,4-dimethyl-2-methylsulfonyl-phenyl)amino]methyl]-N-(4-piperidin-1-ylsulfonylphenyl)benzamide Openeye Name: 4-[(3,4-dimethyl-2-methylsulfonyl-anilino)methyl]-N-[4-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 4-[(3,4-dimethyl-2-methylsulfonylanilino)methyl]-N-[4-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-[(3,4-dimethyl-2-methylsulfonylanilino)methyl]-N-(4-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-[(2-mesyl-3,4-dimethyl-anilino)methyl]-N-(4-piperidinosulfonylphenyl)benzamide Formula: C28H33N3O5S2 MolecularWeight: 555.70872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)NCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)NCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)S(=O)(=O)C)C

InChI

InChI=1S/C28H33N3O5S2/c1-20-7-16-26(27(21(20)2)37(3,33)34)29-19-22-8-10-23(11-9-22)28(32)30-24-12-14-25(15-13-24)38(35,36)31-17-5-4-6-18-31/h7-16,29H,4-6,17-19H2,1-3H3,(H,30,32)