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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[3-cyano-4-(2-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[3-cyano-4-(2-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-phenyl-2-pyridyl]thio]acetamide Formula: C28H20N4O2S2 MolecularWeight: 508.614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC(=O)NC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC(=O)NC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C28H20N4O2S2/c1-34-24-13-7-5-11-19(24)20-15-23(18-9-3-2-4-10-18)30-27(21(20)16-29)35-17-26(33)32-28-31-22-12-6-8-14-25(22)36-28/h2-15H,17H2,1H3,(H,31,32,33)