4-tert-butyl-N-[3-[2-[methylsulfonyl(naphthalen-1-yl)amino]ethanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-[methylsulfonyl(naphthalen-1-yl)amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-[methylsulfonyl(1-naphthyl)amino]acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-[methylsulfonyl(1-naphthalenyl)amino]-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-[methylsulfonyl(naphthalen-1-yl)amino]acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-[mesyl(1-naphthyl)amino]acetyl]amino]phenyl]benzamide Formula: C30H31N3O4S MolecularWeight: 529.64984

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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=CC4=CC=CC=C43)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=CC4=CC=CC=C43)S(=O)(=O)C

InChI

InChI=1S/C30H31N3O4S/c1-30(2,3)23-17-15-22(16-18-23)29(35)32-25-12-8-11-24(19-25)31-28(34)20-33(38(4,36)37)27-14-7-10-21-9-5-6-13-26(21)27/h5-19H,20H2,1-4H3,(H,31,34)(H,32,35)