5-bromanyl-4-(3-ethynylphenyl)azanidylsulfonyl-thiophene-2-carboxylate

Systemtic Name: 5-bromanyl-4-(3-ethynylphenyl)azanidylsulfonyl-thiophene-2-carboxylate Openeye Name: 5-bromo-4-(3-ethynylphenyl)azanidylsulfonyl-thiophene-2-carboxylate CAS Name: 5-bromo-4-(3-ethynylphenyl)azanidylsulfonyl-2-thiophenecarboxylate IUPAC Name: 5-bromo-4-(3-ethynylphenyl)azanidylsulfonylthiophene-2-carboxylate Traditional Name: 5-bromo-4-(3-ethynylphenyl)azanidylsulfonyl-2-thenoate Formula: C13H6BrNO4S2-2 MolecularWeight: 384.22504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7BrNO4S2/c1-2-8-4-3-5-9(6-8)15-21(18,19)11-7-10(13(16)17)20-12(11)14/h1,3-7H,(H,16,17)/q-1/p-1