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

Systemtic Name: 4-tert-butyl-N-[3-[2-[(3-ethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-(3-ethoxy-N-methylsulfonyl-anilino)acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(3-ethoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(3-ethoxy-N-methylsulfonylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(3-ethoxy-N-mesyl-anilino)acetyl]amino]phenyl]benzamide Formula: C28H33N3O5S MolecularWeight: 523.64372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC(=C1)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C28H33N3O5S/c1-6-36-25-12-8-11-24(18-25)31(37(5,34)35)19-26(32)29-22-9-7-10-23(17-22)30-27(33)20-13-15-21(16-14-20)28(2,3)4/h7-18H,6,19H2,1-5H3,(H,29,32)(H,30,33)