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

Systemtic Name: N-(4-phenoxyphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(4-phenoxyphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(4-phenoxyphenyl)acetamide IUPAC Name: N-(4-phenoxyphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(4-phenoxyphenyl)-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C27H23N3O2S2 MolecularWeight: 485.62042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H23N3O2S2/c31-26(28-21-14-16-24(17-15-21)32-23-11-5-2-6-12-23)19-34-25-13-7-10-22(18-25)30-27(33)29-20-8-3-1-4-9-20/h1-18H,19H2,(H,28,31)(H2,29,30,33)