N-(4-bromophenyl)-2-[6-(4-bromophenyl)-3-cyano-4-phenyl-pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-bromophenyl)-2-[6-(4-bromophenyl)-3-cyano-4-phenyl-pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-bromophenyl)-2-[[6-(4-bromophenyl)-3-cyano-4-phenyl-2-pyridyl]sulfanyl]propanamide CAS Name: N-(4-bromophenyl)-2-[[6-(4-bromophenyl)-3-cyano-4-phenyl-2-pyridinyl]thio]propanamide IUPAC Name: N-(4-bromophenyl)-2-[6-(4-bromophenyl)-3-cyano-4-phenylpyridin-2-yl]sulfanylpropanamide Traditional Name: N-(4-bromophenyl)-2-[[6-(4-bromophenyl)-3-cyano-4-phenyl-2-pyridyl]thio]propionamide Formula: C27H19Br2N3OS MolecularWeight: 593.33226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Br)SC2=C(C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C#N

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)Br)SC2=C(C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C#N

InChI

InChI=1S/C27H19Br2N3OS/c1-17(26(33)31-22-13-11-21(29)12-14-22)34-27-24(16-30)23(18-5-3-2-4-6-18)15-25(32-27)19-7-9-20(28)10-8-19/h2-15,17H,1H3,(H,31,33)