2-methyl-4-nitro-N-(2-sulfanylethyl)pyrazole-3-carboxamide

Systemtic Name: 2-methyl-4-nitro-N-(2-sulfanylethyl)pyrazole-3-carboxamide Openeye Name: 2-methyl-4-nitro-N-(2-sulfanylethyl)pyrazole-3-carboxamide CAS Name: N-(2-mercaptoethyl)-2-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: 2-methyl-4-nitro-N-(2-sulfanylethyl)pyrazole-3-carboxamide Traditional Name: N-(2-mercaptoethyl)-2-methyl-4-nitro-pyrazole-3-carboxamide Formula: C7H10N4O3S MolecularWeight: 230.2443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCCS

Isomeric SMILES

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCCS

InChI

InChI=1S/C7H10N4O3S/c1-10-6(7(12)8-2-3-15)5(4-9-10)11(13)14/h4,15H,2-3H2,1H3,(H,8,12)