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

Systemtic Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]acetamide CAS Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-N-prop-2-enylacetamide IUPAC Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]acetamide Formula: C9H12N4O3S MolecularWeight: 256.28158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SCC(=O)NCC=C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)SCC(=O)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C9H12N4O3S/c1-3-4-10-7(14)5-17-9-8(13(15)16)6(2)11-12-9/h3H,1,4-5H2,2H3,(H,10,14)(H,11,12)