2,6-dimethoxy-N-[5-(3-methylheptan-3-yl)-1,2-oxazol-3-yl]benzenecarbothioamide

Systemtic Name: 2,6-dimethoxy-N-[5-(3-methylheptan-3-yl)-1,2-oxazol-3-yl]benzenecarbothioamide Openeye Name: N-[5-(1-ethyl-1-methyl-pentyl)isoxazol-3-yl]-2,6-dimethoxy-benzenecarbothioamide CAS Name: 2,6-dimethoxy-N-[5-(3-methylheptan-3-yl)-3-isoxazolyl]benzenecarbothioamide IUPAC Name: 2,6-dimethoxy-N-[5-(3-methylheptan-3-yl)-1,2-oxazol-3-yl]benzenecarbothioamide Traditional Name: N-[5-(1-ethyl-1-methyl-pentyl)isoxazol-3-yl]-2,6-dimethoxy-thiobenzamide Formula: C20H28N2O3S MolecularWeight: 376.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC)C1=CC(=NO1)NC(=S)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCCCC(C)(CC)C1=CC(=NO1)NC(=S)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C20H28N2O3S/c1-6-8-12-20(3,7-2)16-13-17(22-25-16)21-19(26)18-14(23-4)10-9-11-15(18)24-5/h9-11,13H,6-8,12H2,1-5H3,(H,21,22,26)