N-(4-phenoxyphenyl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(4-phenoxyphenyl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(4-phenoxyphenyl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(4-phenoxyphenyl)-2-phenylacetamide IUPAC Name: N-(4-phenoxyphenyl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(4-phenoxyphenyl)-2-phenyl-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C33H27N3O2S2 MolecularWeight: 561.71638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)SC4=CC=C(C=C4)NC(=S)NC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)SC4=CC=C(C=C4)NC(=S)NC5=CC=CC=C5

InChI

InChI=1S/C33H27N3O2S2/c37-32(34-26-16-20-29(21-17-26)38-28-14-8-3-9-15-28)31(24-10-4-1-5-11-24)40-30-22-18-27(19-23-30)36-33(39)35-25-12-6-2-7-13-25/h1-23,31H,(H,34,37)(H2,35,36,39)