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

Systemtic Name: N-(4-bromophenyl)-2-[3-cyano-4-(2-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[3-cyano-4-(2-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-phenyl-2-pyridyl]thio]acetamide Formula: C27H20BrN3O2S MolecularWeight: 530.4356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C27H20BrN3O2S/c1-33-25-10-6-5-9-21(25)22-15-24(18-7-3-2-4-8-18)31-27(23(22)16-29)34-17-26(32)30-20-13-11-19(28)12-14-20/h2-15H,17H2,1H3,(H,30,32)