N-[[1-[(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]piperidin-4-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[[1-[(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]piperidin-4-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[[1-[(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-4-piperidyl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[[1-[(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-4-piperidinyl]methyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[[1-[(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]piperidin-4-yl]methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[[1-[(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-4-piperidyl]methyl]-2-(methylthio)nicotinamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(O2)CN3CCC(CC3)CNC(=O)C4=C(N=CC=C4)SC

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(O2)CN3CCC(CC3)CNC(=O)C4=C(N=CC=C4)SC

InChI

InChI=1S/C23H29N3O3S/c1-16-5-6-20-21(12-16)29-18(15-28-20)14-26-10-7-17(8-11-26)13-25-22(27)19-4-3-9-24-23(19)30-2/h3-6,9,12,17-18H,7-8,10-11,13-15H2,1-2H3,(H,25,27)