4-bromanyl-N-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)benzenecarboximidate

Systemtic Name: 4-bromanyl-N-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)benzenecarboximidate Openeye Name: 4-bromo-N-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)benzenecarboximidate CAS Name: 4-bromo-N-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)benzenecarboximidate IUPAC Name: 4-bromo-N-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)benzenecarboximidate Traditional Name: 4-bromo-N-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)benzenecarboximidate Formula: C13H13BrN3O3S2- MolecularWeight: 403.29462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=NN=C(S1)N=C(C2=CC=C(C=C2)Br)[O-]

Isomeric SMILES

CCCCS(=O)(=O)C1=NN=C(S1)N=C(C2=CC=C(C=C2)Br)[O-]

InChI

InChI=1S/C13H14BrN3O3S2/c1-2-3-8-22(19,20)13-17-16-12(21-13)15-11(18)9-4-6-10(14)7-5-9/h4-7H,2-3,8H2,1H3,(H,15,16,18)/p-1