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

Systemtic Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-acetamide CAS Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]-2-phenylacetamide IUPAC Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanylacetamide Traditional Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-2-[[3-[(2-phenylacetyl)amino]phenyl]thio]acetamide Formula: C35H27N3O3S MolecularWeight: 569.67218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6O5

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6O5

InChI

InChI=1S/C35H27N3O3S/c39-32(22-24-10-3-1-4-11-24)36-28-14-9-15-29(23-28)42-33(25-12-5-2-6-13-25)34(40)37-27-20-18-26(19-21-27)35-38-30-16-7-8-17-31(30)41-35/h1-21,23,33H,22H2,(H,36,39)(H,37,40)