N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-tert-butylisoxazol-5-yl)-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(3-tert-butyl-5-isoxazolyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(3-tert-butylisoxazol-5-yl)-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1)NC(=O)CSC2=NC=CN2C

Isomeric SMILES

CC(C)(C)C1=NOC(=C1)NC(=O)CSC2=NC=CN2C

InChI

InChI=1S/C13H18N4O2S/c1-13(2,3)9-7-11(19-16-9)15-10(18)8-20-12-14-5-6-17(12)4/h5-7H,8H2,1-4H3,(H,15,18)