N-(1,3-benzodioxol-5-yl)-2-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylethanoylamino]benzamide Openeye Name: 2-[[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]acetyl]amino]-N-(1,3-benzodioxol-5-yl)benzamide CAS Name: 2-[[2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-1-oxoethyl]amino]-N-(1,3-benzodioxol-5-yl)benzamide IUPAC Name: 2-[[2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanylacetyl]amino]-N-(1,3-benzodioxol-5-yl)benzamide Traditional Name: 2-[[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]acetyl]amino]-N-(1,3-benzodioxol-5-yl)benzamide Formula: C25H20N4O5S MolecularWeight: 488.5151

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4)C#N)C(=O)C

InChI

InChI=1S/C25H20N4O5S/c1-14-19(15(2)30)9-16(11-26)25(27-14)35-12-23(31)29-20-6-4-3-5-18(20)24(32)28-17-7-8-21-22(10-17)34-13-33-21/h3-10H,12-13H2,1-2H3,(H,28,32)(H,29,31)