N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(methylthio)nicotinamide Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H16N2O3S/c1-22-16-12(3-2-6-17-16)15(19)18-10-11-4-5-13-14(9-11)21-8-7-20-13/h2-6,9H,7-8,10H2,1H3,(H,18,19)