N-(1,3-benzodioxol-5-yl)-2-[3-(2-phenylmorpholin-4-yl)carbonylpyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[3-(2-phenylmorpholin-4-yl)carbonylpyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[[3-(2-phenylmorpholine-4-carbonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[3-[oxo-(2-phenyl-4-morpholinyl)methyl]-2-pyridinyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[3-(2-phenylmorpholine-4-carbonyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[3-(2-phenylmorpholine-4-carbonyl)-2-pyridyl]thio]acetamide Formula: C25H23N3O5S MolecularWeight: 477.53222

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=O)C2=C(N=CC=C2)SCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

C1COC(CN1C(=O)C2=C(N=CC=C2)SCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C25H23N3O5S/c29-23(27-18-8-9-20-21(13-18)33-16-32-20)15-34-24-19(7-4-10-26-24)25(30)28-11-12-31-22(14-28)17-5-2-1-3-6-17/h1-10,13,22H,11-12,14-16H2,(H,27,29)