5-[(2-methylsulfanylphenoxy)methyl]-N-(4-pyrazol-1-ylbutan-2-yl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(2-methylsulfanylphenoxy)methyl]-N-(4-pyrazol-1-ylbutan-2-yl)-1,2-oxazole-3-carboxamide Openeye Name: N-(1-methyl-3-pyrazol-1-yl-propyl)-5-[(2-methylsulfanylphenoxy)methyl]isoxazole-3-carboxamide CAS Name: 5-[[2-(methylthio)phenoxy]methyl]-N-[4-(1-pyrazolyl)butan-2-yl]-3-isoxazolecarboxamide IUPAC Name: 5-[(2-methylsulfanylphenoxy)methyl]-N-(4-pyrazol-1-ylbutan-2-yl)-1,2-oxazole-3-carboxamide Traditional Name: N-(1-methyl-3-pyrazol-1-yl-propyl)-5-[[2-(methylthio)phenoxy]methyl]isoxazole-3-carboxamide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=CC=N1)NC(=O)C2=NOC(=C2)COC3=CC=CC=C3SC

Isomeric SMILES

CC(CCN1C=CC=N1)NC(=O)C2=NOC(=C2)COC3=CC=CC=C3SC

InChI

InChI=1S/C19H22N4O3S/c1-14(8-11-23-10-5-9-20-23)21-19(24)16-12-15(26-22-16)13-25-17-6-3-4-7-18(17)27-2/h3-7,9-10,12,14H,8,11,13H2,1-2H3,(H,21,24)