(4-bromanyl-2-methoxycarbonyl-phenyl)sulfonyl-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]azanide

Systemtic Name: (4-bromanyl-2-methoxycarbonyl-phenyl)sulfonyl-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]azanide Openeye Name: (4-bromo-2-methoxycarbonyl-phenyl)sulfonyl-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]azanide CAS Name: (4-bromo-2-methoxycarbonylphenyl)sulfonyl-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]azanide IUPAC Name: (4-bromo-2-methoxycarbonylphenyl)sulfonyl-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]azanide Traditional Name: (4-bromo-2-carbomethoxy-phenyl)sulfonyl-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]azanide Formula: C17H14BrN4O4S2- MolecularWeight: 482.35146

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=CC=C(C=C2)[N-]S(=O)(=O)C3=C(C=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CN1C=NN=C1SC2=CC=C(C=C2)[N-]S(=O)(=O)C3=C(C=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C17H14BrN4O4S2/c1-22-10-19-20-17(22)27-13-6-4-12(5-7-13)21-28(24,25)15-8-3-11(18)9-14(15)16(23)26-2/h3-10H,1-2H3/q-1