N-(2-ethyl-6-methyl-phenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-2-phenyl-ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-2-phenyl-ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-2-phenyl-acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[[3-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]phenyl]thio]-2-phenylacetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-2-phenylacetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[[3-[(2-methoxyphenyl)thiocarbamoylamino]phenyl]thio]-2-phenyl-acetamide Formula: C31H31N3O2S2 MolecularWeight: 541.72674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=S)NC4=CC=CC=C4OC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=S)NC4=CC=CC=C4OC)C

InChI

InChI=1S/C31H31N3O2S2/c1-4-22-15-10-12-21(2)28(22)34-30(35)29(23-13-6-5-7-14-23)38-25-17-11-16-24(20-25)32-31(37)33-26-18-8-9-19-27(26)36-3/h5-20,29H,4H2,1-3H3,(H,34,35)(H2,32,33,37)