N-[3-[2-[(3-bromophenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]-4-tert-butyl-benzamide

Systemtic Name: N-[3-[2-[(3-bromophenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[3-[[2-(3-bromo-N-methylsulfonyl-anilino)acetyl]amino]phenyl]-4-tert-butyl-benzamide CAS Name: N-[3-[[2-(3-bromo-N-methylsulfonylanilino)-1-oxoethyl]amino]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[3-[[2-(3-bromo-N-methylsulfonylanilino)acetyl]amino]phenyl]-4-tert-butylbenzamide Traditional Name: N-[3-[[2-(3-bromo-N-mesyl-anilino)acetyl]amino]phenyl]-4-tert-butyl-benzamide Formula: C26H28BrN3O4S MolecularWeight: 558.48722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)CN(C3=CC(=CC=C3)Br)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)CN(C3=CC(=CC=C3)Br)S(=O)(=O)C

InChI

InChI=1S/C26H28BrN3O4S/c1-26(2,3)19-13-11-18(12-14-19)25(32)29-22-9-6-8-21(16-22)28-24(31)17-30(35(4,33)34)23-10-5-7-20(27)15-23/h5-16H,17H2,1-4H3,(H,28,31)(H,29,32)