4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(naphthalen-1-ylsulfamoyl)phenyl]butanamide

Systemtic Name: 4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(naphthalen-1-ylsulfamoyl)phenyl]butanamide Openeye Name: 4-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[4-(1-naphthylsulfamoyl)phenyl]butanamide CAS Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-[4-(1-naphthalenylsulfamoyl)phenyl]butanamide IUPAC Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-[4-(naphthalen-1-ylsulfamoyl)phenyl]butanamide Traditional Name: 4-(N-mesyl-2,5-dimethyl-anilino)-N-[4-(1-naphthylsulfamoyl)phenyl]butyramide Formula: C29H31N3O5S2 MolecularWeight: 565.70354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC4=CC=CC=C43)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC4=CC=CC=C43)S(=O)(=O)C

InChI

InChI=1S/C29H31N3O5S2/c1-21-13-14-22(2)28(20-21)32(38(3,34)35)19-7-12-29(33)30-24-15-17-25(18-16-24)39(36,37)31-27-11-6-9-23-8-4-5-10-26(23)27/h4-6,8-11,13-18,20,31H,7,12,19H2,1-3H3,(H,30,33)