[2-bromanyl-4-[[(4-cyanophenyl)-imidazol-1-yl-amino]methyl]phenyl] sulfamate

Systemtic Name: [2-bromanyl-4-[[(4-cyanophenyl)-imidazol-1-yl-amino]methyl]phenyl] sulfamate Openeye Name: [2-bromo-4-[(4-cyano-N-imidazol-1-yl-anilino)methyl]phenyl] sulfamate CAS Name: sulfamic acid [2-bromo-4-[[4-cyano-N-(1-imidazolyl)anilino]methyl]phenyl] ester IUPAC Name: [2-bromo-4-[(4-cyano-N-imidazol-1-ylanilino)methyl]phenyl] sulfamate Traditional Name: sulfamic acid [2-bromo-4-[(4-cyano-N-imidazol-1-yl-anilino)methyl]phenyl] ester Formula: C17H14BrN5O3S MolecularWeight: 448.29376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N(CC2=CC(=C(C=C2)OS(=O)(=O)N)Br)N3C=CN=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)N(CC2=CC(=C(C=C2)OS(=O)(=O)N)Br)N3C=CN=C3

InChI

InChI=1S/C17H14BrN5O3S/c18-16-9-14(3-6-17(16)26-27(20,24)25)11-23(22-8-7-21-12-22)15-4-1-13(10-19)2-5-15/h1-9,12H,11H2,(H2,20,24,25)