N-tert-butyl-N-[3-[[3-(methylsulfonylamino)phenyl]carbamoylamino]-2-oxidanylidene-5,7-diphenyl-azepan-1-yl]ethanamide

Systemtic Name: N-tert-butyl-N-[3-[[3-(methylsulfonylamino)phenyl]carbamoylamino]-2-oxidanylidene-5,7-diphenyl-azepan-1-yl]ethanamide Openeye Name: N-tert-butyl-N-[3-[[3-(methanesulfonamido)phenyl]carbamoylamino]-2-oxo-5,7-diphenyl-azepan-1-yl]acetamide CAS Name: N-tert-butyl-N-[3-[[[3-(methanesulfonamido)anilino]-oxomethyl]amino]-2-oxo-5,7-diphenyl-1-azepanyl]acetamide IUPAC Name: N-tert-butyl-N-[3-[[3-(methanesulfonamido)phenyl]carbamoylamino]-2-oxo-5,7-diphenylazepan-1-yl]acetamide Traditional Name: N-tert-butyl-N-[2-keto-3-[[3-(methanesulfonamido)phenyl]carbamoylamino]-5,7-diphenyl-azepan-1-yl]acetamide Formula: C32H39N5O5S MolecularWeight: 605.74756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)NC(=O)NC2=CC(=CC=C2)NS(=O)(=O)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)NC(=O)NC2=CC(=CC=C2)NS(=O)(=O)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H39N5O5S/c1-22(38)37(32(2,3)4)36-29(24-15-10-7-11-16-24)20-25(23-13-8-6-9-14-23)19-28(30(36)39)34-31(40)33-26-17-12-18-27(21-26)35-43(5,41)42/h6-18,21,25,28-29,35H,19-20H2,1-5H3,(H2,33,34,40)