N-(1,3-benzoxazol-2-yl)-2-[3-cyano-4-(3-fluorophenyl)-6-phenyl-pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzoxazol-2-yl)-2-[3-cyano-4-(3-fluorophenyl)-6-phenyl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzoxazol-2-yl)-2-[[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-(1,3-benzoxazol-2-yl)-2-[[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridinyl]thio]acetamide IUPAC Name: N-(1,3-benzoxazol-2-yl)-2-[3-cyano-4-(3-fluorophenyl)-6-phenylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzoxazol-2-yl)-2-[[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridyl]thio]acetamide Formula: C27H17FN4O2S MolecularWeight: 480.512883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC(=CC=C3)F)C#N)SCC(=O)NC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC(=CC=C3)F)C#N)SCC(=O)NC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C27H17FN4O2S/c28-19-10-6-9-18(13-19)20-14-23(17-7-2-1-3-8-17)30-26(21(20)15-29)35-16-25(33)32-27-31-22-11-4-5-12-24(22)34-27/h1-14H,16H2,(H,31,32,33)