N-[2,4-bis(bromanyl)phenyl]-2-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2,4-bis(bromanyl)phenyl]-2-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(2,4-dibromophenyl)acetamide CAS Name: 2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2,4-dibromophenyl)acetamide IUPAC Name: 2-[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2,4-dibromophenyl)acetamide Traditional Name: 2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(2,4-dibromophenyl)acetamide Formula: C27H19Br2N3O2S MolecularWeight: 609.33166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=C(C=C(C=C3)Br)Br)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=C(C=C(C=C3)Br)Br)C4=CC=CC=C4

InChI

InChI=1S/C27H19Br2N3O2S/c1-34-20-10-7-17(8-11-20)21-14-25(18-5-3-2-4-6-18)32-27(22(21)15-30)35-16-26(33)31-24-12-9-19(28)13-23(24)29/h2-14H,16H2,1H3,(H,31,33)