[3-bromanyl-4-(2-phenylsulfanylethanoylamino)phenyl] thiocyanate

Systemtic Name: [3-bromanyl-4-(2-phenylsulfanylethanoylamino)phenyl] thiocyanate Openeye Name: [3-bromo-4-[(2-phenylsulfanylacetyl)amino]phenyl] thiocyanate CAS Name: thiocyanic acid [3-bromo-4-[[1-oxo-2-(phenylthio)ethyl]amino]phenyl] ester IUPAC Name: [3-bromo-4-[(2-phenylsulfanylacetyl)amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3-bromo-4-[[2-(phenylthio)acetyl]amino]phenyl] ester Formula: C15H11BrN2OS2 MolecularWeight: 379.29464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)SC#N)Br

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)SC#N)Br

InChI

InChI=1S/C15H11BrN2OS2/c16-13-8-12(21-10-17)6-7-14(13)18-15(19)9-20-11-4-2-1-3-5-11/h1-8H,9H2,(H,18,19)