5-[(Z)-C-methyl-N-(1H-pyrrol-2-ylcarbonylamino)carbonimidoyl]thiophene-2-carboxylate

Systemtic Name: 5-[(Z)-C-methyl-N-(1H-pyrrol-2-ylcarbonylamino)carbonimidoyl]thiophene-2-carboxylate Openeye Name: 5-[(Z)-C-methyl-N-(1H-pyrrole-2-carbonylamino)carbonimidoyl]thiophene-2-carboxylate CAS Name: 5-[(1Z)-1-[[oxo(1H-pyrrol-2-yl)methyl]hydrazinylidene]ethyl]-2-thiophenecarboxylate IUPAC Name: 5-[(Z)-C-methyl-N-(1H-pyrrole-2-carbonylamino)carbonimidoyl]thiophene-2-carboxylate Traditional Name: 5-[(Z)-C-methyl-N-(1H-pyrrole-2-carbonylamino)carbonimidoyl]-2-thenoate Formula: C12H10N3O3S- MolecularWeight: 276.2911

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CN1)C2=CC=C(S2)C(=O)[O-]

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=CN1)/C2=CC=C(S2)C(=O)[O-]

InChI

InChI=1S/C12H11N3O3S/c1-7(9-4-5-10(19-9)12(17)18)14-15-11(16)8-3-2-6-13-8/h2-6,13H,1H3,(H,15,16)(H,17,18)/p-1/b14-7-