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

Systemtic Name: N-(2-bromophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(2-bromophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(2-bromophenyl)acetamide IUPAC Name: N-(2-bromophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(2-bromophenyl)-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C21H18BrN3OS2 MolecularWeight: 472.42112

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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=CC=C3Br

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SCC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C21H18BrN3OS2/c22-18-11-4-5-12-19(18)25-20(26)14-28-17-10-6-9-16(13-17)24-21(27)23-15-7-2-1-3-8-15/h1-13H,14H2,(H,25,26)(H2,23,24,27)