N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-phenyl-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-phenyl-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-phenyl-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-phenyl-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-phenyl-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C29H26ClN3O3S2 MolecularWeight: 564.11804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=S)NC4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=S)NC4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C29H26ClN3O3S2/c1-35-25-18-26(36-2)24(17-23(25)30)33-28(34)27(19-10-5-3-6-11-19)38-22-15-9-14-21(16-22)32-29(37)31-20-12-7-4-8-13-20/h3-18,27H,1-2H3,(H,33,34)(H2,31,32,37)