N-(3-hydroxyphenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-hydroxyphenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-hydroxyphenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]acetamide CAS Name: N-(3-hydroxyphenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]acetamide IUPAC Name: N-(3-hydroxyphenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-hydroxyphenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]acetamide Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SCC(=O)NC2=CC(=CC=C2)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)SCC(=O)NC2=CC(=CC=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4S/c1-7-11(16(19)20)12(15-14-7)21-6-10(18)13-8-3-2-4-9(17)5-8/h2-5,17H,6H2,1H3,(H,13,18)(H,14,15)