N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide Openeye Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-acetamide CAS Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenylacetamide IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenylacetamide Traditional Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-acetamide Formula: C33H25N3O4S2 MolecularWeight: 591.6993

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)SC5=CC=C(C=C5)NS(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)SC5=CC=C(C=C5)NS(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C33H25N3O4S2/c37-32(34-25-17-15-24(16-18-25)33-35-29-13-7-8-14-30(29)40-33)31(23-9-3-1-4-10-23)41-27-21-19-26(20-22-27)36-42(38,39)28-11-5-2-6-12-28/h1-22,31,36H,(H,34,37)