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

Systemtic Name: 4-tert-butyl-N-[3-[2-[(4-chlorophenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-(4-chloro-N-methylsulfonyl-anilino)acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(4-chloro-N-methylsulfonylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(4-chloro-N-methylsulfonylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(4-chloro-N-mesyl-anilino)acetyl]amino]phenyl]benzamide Formula: C26H28ClN3O4S MolecularWeight: 514.03622

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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=C(C=C3)Cl)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=C(C=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C26H28ClN3O4S/c1-26(2,3)19-10-8-18(9-11-19)25(32)29-22-7-5-6-21(16-22)28-24(31)17-30(35(4,33)34)23-14-12-20(27)13-15-23/h5-16H,17H2,1-4H3,(H,28,31)(H,29,32)