sodium 4-azanyl-3-ethoxycarbonyl-5-(phenylcarbonyl)thiophene-2-thiolate

Systemtic Name: sodium 4-azanyl-3-ethoxycarbonyl-5-(phenylcarbonyl)thiophene-2-thiolate Openeye Name: sodium 4-amino-5-benzoyl-3-ethoxycarbonyl-thiophene-2-thiolate CAS Name: sodium 4-amino-5-benzoyl-3-ethoxycarbonyl-2-thiophenethiolate IUPAC Name: sodium 4-amino-5-benzoyl-3-ethoxycarbonylthiophene-2-thiolate Traditional Name: sodium 4-amino-5-benzoyl-3-carbethoxy-thiophene-2-thiolate Formula: C14H12NNaO3S2 MolecularWeight: 329.36975

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1N)C(=O)C2=CC=CC=C2)[S-].[Na+]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1N)C(=O)C2=CC=CC=C2)[S-].[Na+]

InChI

InChI=1S/C14H13NO3S2.Na/c1-2-18-13(17)9-10(15)12(20-14(9)19)11(16)8-6-4-3-5-7-8;/h3-7,19H,2,15H2,1H3;/q;+1/p-1