(4-bromanyl-2-methoxycarbonyl-phenyl)sulfonyl-(2-pyrazol-1-ylphenyl)azanide

Systemtic Name: (4-bromanyl-2-methoxycarbonyl-phenyl)sulfonyl-(2-pyrazol-1-ylphenyl)azanide Openeye Name: (4-bromo-2-methoxycarbonyl-phenyl)sulfonyl-(2-pyrazol-1-ylphenyl)azanide CAS Name: (4-bromo-2-methoxycarbonylphenyl)sulfonyl-[2-(1-pyrazolyl)phenyl]azanide IUPAC Name: (4-bromo-2-methoxycarbonylphenyl)sulfonyl-(2-pyrazol-1-ylphenyl)azanide Traditional Name: (4-bromo-2-carbomethoxy-phenyl)sulfonyl-(2-pyrazol-1-ylphenyl)azanide Formula: C17H13BrN3O4S- MolecularWeight: 435.27182

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)[N-]C2=CC=CC=C2N3C=CC=N3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)[N-]C2=CC=CC=C2N3C=CC=N3

InChI

InChI=1S/C17H13BrN3O4S/c1-25-17(22)13-11-12(18)7-8-16(13)26(23,24)20-14-5-2-3-6-15(14)21-10-4-9-19-21/h2-11H,1H3/q-1