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

Systemtic Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-(p-tolyl)acetamide CAS Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-N-(p-tolyl)acetamide Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NNC(=C2[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NNC(=C2[N+](=O)[O-])C

InChI

InChI=1S/C13H14N4O3S/c1-8-3-5-10(6-4-8)14-11(18)7-21-13-12(17(19)20)9(2)15-16-13/h3-6H,7H2,1-2H3,(H,14,18)(H,15,16)