2-[3-[(4-ethanoylphenyl)carbamothioylamino]phenyl]sulfanyl-N-naphthalen-1-yl-2-phenyl-ethanamide

Systemtic Name: 2-[3-[(4-ethanoylphenyl)carbamothioylamino]phenyl]sulfanyl-N-naphthalen-1-yl-2-phenyl-ethanamide Openeye Name: 2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(1-naphthyl)-2-phenyl-acetamide CAS Name: 2-[[3-[[(4-acetylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-N-(1-naphthalenyl)-2-phenylacetamide IUPAC Name: 2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-N-naphthalen-1-yl-2-phenylacetamide Traditional Name: 2-[[3-[(4-acetylphenyl)thiocarbamoylamino]phenyl]thio]-N-(1-naphthyl)-2-phenyl-acetamide Formula: C33H27N3O2S2 MolecularWeight: 561.71638

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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=CC5=CC=CC=C54

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C33H27N3O2S2/c1-22(37)23-17-19-26(20-18-23)34-33(39)35-27-13-8-14-28(21-27)40-31(25-10-3-2-4-11-25)32(38)36-30-16-7-12-24-9-5-6-15-29(24)30/h2-21,31H,1H3,(H,36,38)(H2,34,35,39)