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

Systemtic Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-[(4-methylphenyl)methyl-methylsulfonyl-amino]benzamide Openeye Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-[methylsulfonyl(p-tolylmethyl)amino]benzamide CAS Name: N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-4-[(4-methylphenyl)methyl-methylsulfonylamino]benzamide IUPAC Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)-4-[(4-methylphenyl)methyl-methylsulfonylamino]benzamide Traditional Name: 4-[mesyl-(4-methylbenzyl)amino]-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)benzamide Formula: C27H31N3O6S2 MolecularWeight: 557.68154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O6S2/c1-20-6-8-21(9-7-20)19-30(37(3,32)33)23-12-10-22(11-13-23)27(31)28-25-18-24(14-15-26(25)36-2)38(34,35)29-16-4-5-17-29/h6-15,18H,4-5,16-17,19H2,1-3H3,(H,28,31)