N-(2,6-dimethylphenyl)-2-[(5-oxidanylidene-1,2-dihydropyrazol-3-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[(5-oxidanylidene-1,2-dihydropyrazol-3-yl)methylsulfanyl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[(5-oxo-1,2-dihydropyrazol-3-yl)methylsulfanyl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[(5-oxo-1,2-dihydropyrazol-3-yl)methylthio]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[(5-oxo-1,2-dihydropyrazol-3-yl)methylsulfanyl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(5-keto-3-pyrazolin-3-yl)methylthio]acetamide Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSCC2=CC(=O)NN2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSCC2=CC(=O)NN2

InChI

InChI=1S/C14H17N3O2S/c1-9-4-3-5-10(2)14(9)15-13(19)8-20-7-11-6-12(18)17-16-11/h3-6H,7-8H2,1-2H3,(H,15,19)(H2,16,17,18)