2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-phenoxyphenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-phenoxyphenyl)-2-phenyl-ethanamide Openeye Name: N-(4-phenoxyphenyl)-2-phenyl-2-[3-(p-tolylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[3-[[(4-methylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-N-(4-phenoxyphenyl)-2-phenylacetamide IUPAC Name: 2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-phenoxyphenyl)-2-phenylacetamide Traditional Name: N-(4-phenoxyphenyl)-2-phenyl-2-[[3-(p-tolylthiocarbamoylamino)phenyl]thio]acetamide Formula: C34H29N3O2S2 MolecularWeight: 575.74296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C34H29N3O2S2/c1-24-15-17-27(18-16-24)36-34(40)37-28-11-8-14-31(23-28)41-32(25-9-4-2-5-10-25)33(38)35-26-19-21-30(22-20-26)39-29-12-6-3-7-13-29/h2-23,32H,1H3,(H,35,38)(H2,36,37,40)