N-[[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[[5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[[5-(1,3-benzodioxol-5-yl)-3-isoxazolyl]methyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[[5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methyl]-2-(methylthio)nicotinamide Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCC2=NOC(=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCC2=NOC(=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15N3O4S/c1-26-18-13(3-2-6-19-18)17(22)20-9-12-8-15(25-21-12)11-4-5-14-16(7-11)24-10-23-14/h2-8H,9-10H2,1H3,(H,20,22)