1,5-dimethyl-4-nitro-N-(2-sulfanylethyl)pyrazole-3-carboxamide

Systemtic Name: 1,5-dimethyl-4-nitro-N-(2-sulfanylethyl)pyrazole-3-carboxamide Openeye Name: 1,5-dimethyl-4-nitro-N-(2-sulfanylethyl)pyrazole-3-carboxamide CAS Name: N-(2-mercaptoethyl)-1,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1,5-dimethyl-4-nitro-N-(2-sulfanylethyl)pyrazole-3-carboxamide Traditional Name: N-(2-mercaptoethyl)-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C8H12N4O3S MolecularWeight: 244.27088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NCCS)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NCCS)[N+](=O)[O-]

InChI

InChI=1S/C8H12N4O3S/c1-5-7(12(14)15)6(10-11(5)2)8(13)9-3-4-16/h16H,3-4H2,1-2H3,(H,9,13)