2-[(2R)-2-bromanyl-2-cyano-ethyl]-N-(phenylcarbamothioyl)benzamide

Systemtic Name: 2-[(2R)-2-bromanyl-2-cyano-ethyl]-N-(phenylcarbamothioyl)benzamide Openeye Name: 2-[(2R)-2-bromo-2-cyano-ethyl]-N-(phenylcarbamothioyl)benzamide CAS Name: N-[anilino(sulfanylidene)methyl]-2-[(2R)-2-bromo-2-cyanoethyl]benzamide IUPAC Name: 2-[(2R)-2-bromo-2-cyanoethyl]-N-(phenylcarbamothioyl)benzamide Traditional Name: 2-[(2R)-2-bromo-2-cyano-ethyl]-N-(phenylthiocarbamoyl)benzamide Formula: C17H14BrN3OS MolecularWeight: 388.28156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2CC(C#N)Br

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2C[C@H](C#N)Br

InChI

InChI=1S/C17H14BrN3OS/c18-13(11-19)10-12-6-4-5-9-15(12)16(22)21-17(23)20-14-7-2-1-3-8-14/h1-9,13H,10H2,(H2,20,21,22,23)/t13-/m1/s1