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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[3-cyano-4-(2-methoxyphenyl)-6-thiophen-2-yl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-(2-thienyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-thiophen-2-yl-2-pyridinyl]thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[3-cyano-4-(2-methoxyphenyl)-6-thiophen-2-ylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[[3-cyano-4-(2-methoxyphenyl)-6-(2-thienyl)-2-pyridyl]thio]acetamide Formula: C26H18N4O2S3 MolecularWeight: 514.64172

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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=CS5

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC(=O)NC3=NC4=CC=CC=C4S3)C5=CC=CS5

InChI

InChI=1S/C26H18N4O2S3/c1-32-21-9-4-2-7-16(21)17-13-20(22-11-6-12-33-22)28-25(18(17)14-27)34-15-24(31)30-26-29-19-8-3-5-10-23(19)35-26/h2-13H,15H2,1H3,(H,29,30,31)