N-(1,3-benzodioxol-5-yl)-2-pyridin-2-ylsulfanyl-butanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-pyridin-2-ylsulfanyl-butanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(2-pyridylsulfanyl)butanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(2-pyridinylthio)butanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-pyridin-2-ylsulfanylbutanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(2-pyridylthio)butyramide Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=CC=CC=N3

Isomeric SMILES

CCC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=CC=CC=N3

InChI

InChI=1S/C16H16N2O3S/c1-2-14(22-15-5-3-4-8-17-15)16(19)18-11-6-7-12-13(9-11)21-10-20-12/h3-9,14H,2,10H2,1H3,(H,18,19)