N-[[3-methyl-7-(2-phenylsulfanylethanoyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[3-methyl-7-(2-phenylsulfanylethanoyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[3-methyl-7-(2-phenylsulfanylacetyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[3-methyl-7-[1-oxo-2-(phenylthio)ethyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[3-methyl-7-(2-phenylsulfanylacetyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[3-methyl-7-[2-(phenylthio)acetyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-piperonylamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CN(CCC2=C1CNC(=O)C3=CC4=C(C=C3)OCO4)C(=O)CSC5=CC=CC=C5

Isomeric SMILES

CC1=NC=C2CN(CCC2=C1CNC(=O)C3=CC4=C(C=C3)OCO4)C(=O)CSC5=CC=CC=C5

InChI

InChI=1S/C26H25N3O4S/c1-17-22(13-28-26(31)18-7-8-23-24(11-18)33-16-32-23)21-9-10-29(14-19(21)12-27-17)25(30)15-34-20-5-3-2-4-6-20/h2-8,11-12H,9-10,13-16H2,1H3,(H,28,31)