4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 4-[(3-methyl-N-methylsulfonyl-anilino)methyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-[(N-mesyl-3-methyl-anilino)methyl]-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C26H29N3O5S2 MolecularWeight: 527.65556

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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)N4CCCC4)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)N4CCCC4)S(=O)(=O)C

InChI

InChI=1S/C26H29N3O5S2/c1-20-6-5-7-24(18-20)29(35(2,31)32)19-21-8-10-22(11-9-21)26(30)27-23-12-14-25(15-13-23)36(33,34)28-16-3-4-17-28/h5-15,18H,3-4,16-17,19H2,1-2H3,(H,27,30)