2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[4-(diethylsulfamoyl)phenyl]butanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[4-(diethylsulfamoyl)phenyl]butanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[4-(diethylsulfamoyl)phenyl]butanamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[4-(diethylsulfamoyl)phenyl]butanamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[4-(diethylsulfamoyl)phenyl]butanamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-[4-(diethylsulfamoyl)phenyl]butyramide Formula: C21H28ClN3O5S2 MolecularWeight: 502.04712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC)CC)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC)CC)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H28ClN3O5S2/c1-5-20(25(31(4,27)28)18-10-8-9-16(22)15-18)21(26)23-17-11-13-19(14-12-17)32(29,30)24(6-2)7-3/h8-15,20H,5-7H2,1-4H3,(H,23,26)