4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-[(N-mesyl-3,4-dimethyl-anilino)methyl]-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)benzamide Formula: C28H33N3O6S2 MolecularWeight: 571.70812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)OC)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)OC)S(=O)(=O)C)C

InChI

InChI=1S/C28H33N3O6S2/c1-20-7-12-24(17-21(20)2)31(38(4,33)34)19-22-8-10-23(11-9-22)28(32)29-26-18-25(13-14-27(26)37-3)39(35,36)30-15-5-6-16-30/h7-14,17-18H,5-6,15-16,19H2,1-4H3,(H,29,32)