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

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-phenyl-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-phenyl-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(2-ethyl-6-methylphenyl)-2-phenylacetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-phenyl-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-phenyl-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C30H29N3OS2 MolecularWeight: 511.70076

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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=C4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=S)NC4=CC=CC=C4)C

InChI

InChI=1S/C30H29N3OS2/c1-3-22-15-10-12-21(2)27(22)33-29(34)28(23-13-6-4-7-14-23)36-26-19-11-18-25(20-26)32-30(35)31-24-16-8-5-9-17-24/h4-20,28H,3H2,1-2H3,(H,33,34)(H2,31,32,35)