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

Systemtic Name: 4-tert-butyl-N-[3-[2-[(4-ethoxyphenyl)sulfonyl-phenyl-amino]ethanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[[2-(N-(4-ethoxyphenyl)sulfonylanilino)acetyl]amino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(N-(4-ethoxyphenyl)sulfonylanilino)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[[2-(N-(4-ethoxyphenyl)sulfonylanilino)acetyl]amino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[2-(N-p-phenetylsulfonylanilino)acetyl]amino]phenyl]benzamide Formula: C33H35N3O5S MolecularWeight: 585.7131

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C33H35N3O5S/c1-5-41-29-18-20-30(21-19-29)42(39,40)36(28-12-7-6-8-13-28)23-31(37)34-26-10-9-11-27(22-26)35-32(38)24-14-16-25(17-15-24)33(2,3)4/h6-22H,5,23H2,1-4H3,(H,34,37)(H,35,38)