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

Systemtic Name: N-(4-bromophenyl)-2-[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-2-pyridinyl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[4-(4-tert-butylphenyl)-3-cyano-6-phenylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-2-pyridyl]thio]acetamide Formula: C30H26BrN3OS MolecularWeight: 556.51594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H26BrN3OS/c1-30(2,3)22-11-9-20(10-12-22)25-17-27(21-7-5-4-6-8-21)34-29(26(25)18-32)36-19-28(35)33-24-15-13-23(31)14-16-24/h4-17H,19H2,1-3H3,(H,33,35)