2-(4-bromophenyl)carbonyl-4-chloranyl-N-[(4-methylsulfonylphenyl)methyl]-N-(2-oxidanylbutyl)benzamide

Systemtic Name: 2-(4-bromophenyl)carbonyl-4-chloranyl-N-[(4-methylsulfonylphenyl)methyl]-N-(2-oxidanylbutyl)benzamide Openeye Name: 2-(4-bromobenzoyl)-4-chloro-N-(2-hydroxybutyl)-N-[(4-methylsulfonylphenyl)methyl]benzamide CAS Name: 2-[(4-bromophenyl)-oxomethyl]-4-chloro-N-(2-hydroxybutyl)-N-[(4-methylsulfonylphenyl)methyl]benzamide IUPAC Name: 2-(4-bromobenzoyl)-4-chloro-N-(2-hydroxybutyl)-N-[(4-methylsulfonylphenyl)methyl]benzamide Traditional Name: 2-(4-bromobenzoyl)-4-chloro-N-(2-hydroxybutyl)-N-(4-mesylbenzyl)benzamide Formula: C26H25BrClNO5S MolecularWeight: 578.9024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(CC1=CC=C(C=C1)S(=O)(=O)C)C(=O)C2=C(C=C(C=C2)Cl)C(=O)C3=CC=C(C=C3)Br)O

Isomeric SMILES

CCC(CN(CC1=CC=C(C=C1)S(=O)(=O)C)C(=O)C2=C(C=C(C=C2)Cl)C(=O)C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C26H25BrClNO5S/c1-3-21(30)16-29(15-17-4-11-22(12-5-17)35(2,33)34)26(32)23-13-10-20(28)14-24(23)25(31)18-6-8-19(27)9-7-18/h4-14,21,30H,3,15-16H2,1-2H3