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

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[3-[(4-ethanoylphenyl)carbamothioylamino]phenyl]sulfanyl-2-phenyl-ethanamide Openeye Name: 2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(5-chloro-2,4-dimethoxy-phenyl)-2-phenyl-acetamide CAS Name: 2-[[3-[[(4-acetylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide IUPAC Name: 2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide Traditional Name: 2-[[3-[(4-acetylphenyl)thiocarbamoylamino]phenyl]thio]-N-(5-chloro-2,4-dimethoxy-phenyl)-2-phenyl-acetamide Formula: C31H28ClN3O4S2 MolecularWeight: 606.15472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4OC)OC)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4OC)OC)Cl

InChI

InChI=1S/C31H28ClN3O4S2/c1-19(36)20-12-14-22(15-13-20)33-31(40)34-23-10-7-11-24(16-23)41-29(21-8-5-4-6-9-21)30(37)35-26-17-25(32)27(38-2)18-28(26)39-3/h4-18,29H,1-3H3,(H,35,37)(H2,33,34,40)