N-[4-(4-bromophenyl)sulfanylphenyl]-3-cyano-benzamide

Systemtic Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-cyano-benzamide Openeye Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-cyano-benzamide CAS Name: N-[4-[(4-bromophenyl)thio]phenyl]-3-cyanobenzamide IUPAC Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-cyanobenzamide Traditional Name: N-[4-[(4-bromophenyl)thio]phenyl]-3-cyano-benzamide Formula: C20H13BrN2OS MolecularWeight: 409.29902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C20H13BrN2OS/c21-16-4-8-18(9-5-16)25-19-10-6-17(7-11-19)23-20(24)15-3-1-2-14(12-15)13-22/h1-12H,(H,23,24)