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

Systemtic Name: 4-tert-butyl-N-[3-[2-[(4-methoxyphenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-(4-methoxy-N-methylsulfonyl-anilino)acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(4-methoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(4-methoxy-N-methylsulfonylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(N-mesyl-4-methoxy-anilino)acetyl]amino]phenyl]benzamide Formula: C27H31N3O5S MolecularWeight: 509.61714

Click to see the large picture

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)OC)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)OC)S(=O)(=O)C

InChI

InChI=1S/C27H31N3O5S/c1-27(2,3)20-11-9-19(10-12-20)26(32)29-22-8-6-7-21(17-22)28-25(31)18-30(36(5,33)34)23-13-15-24(35-4)16-14-23/h6-17H,18H2,1-5H3,(H,28,31)(H,29,32)