5-(3-ethynylphenyl)azanidylsulfonylthiophene-3-carboxylate

Systemtic Name: 5-(3-ethynylphenyl)azanidylsulfonylthiophene-3-carboxylate Openeye Name: 5-(3-ethynylphenyl)azanidylsulfonylthiophene-3-carboxylate CAS Name: 5-(3-ethynylphenyl)azanidylsulfonyl-3-thiophenecarboxylate IUPAC Name: 5-(3-ethynylphenyl)azanidylsulfonylthiophene-3-carboxylate Traditional Name: 5-(3-ethynylphenyl)azanidylsulfonyl-3-thenoate Formula: C13H7NO4S2-2 MolecularWeight: 305.32898

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)[N-]S(=O)(=O)C2=CC(=CS2)C(=O)[O-]

Isomeric SMILES

C#CC1=CC(=CC=C1)[N-]S(=O)(=O)C2=CC(=CS2)C(=O)[O-]

InChI

InChI=1S/C13H8NO4S2/c1-2-9-4-3-5-11(6-9)14-20(17,18)12-7-10(8-19-12)13(15)16/h1,3-8H,(H,15,16)/q-1/p-1