N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[2-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(2,5-dimethylphenyl)-2-phenylacetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[[2-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C29H27N3OS2 MolecularWeight: 497.67418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3NC(=S)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C29H27N3OS2/c1-20-17-18-21(2)25(19-20)31-28(33)27(22-11-5-3-6-12-22)35-26-16-10-9-15-24(26)32-29(34)30-23-13-7-4-8-14-23/h3-19,27H,1-2H3,(H,31,33)(H2,30,32,34)