[4-[[(4-cyanophenyl)-pyridin-3-yl-amino]methyl]phenyl] sulfamate

Systemtic Name: [4-[[(4-cyanophenyl)-pyridin-3-yl-amino]methyl]phenyl] sulfamate Openeye Name: [4-[[4-cyano-N-(3-pyridyl)anilino]methyl]phenyl] sulfamate CAS Name: sulfamic acid [4-[[4-cyano-N-(3-pyridinyl)anilino]methyl]phenyl] ester IUPAC Name: [4-[(4-cyano-N-pyridin-3-ylanilino)methyl]phenyl] sulfamate Traditional Name: sulfamic acid [4-[[4-cyano-N-(3-pyridyl)anilino]methyl]phenyl] ester Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N4O3S/c20-12-15-3-7-17(8-4-15)23(18-2-1-11-22-13-18)14-16-5-9-19(10-6-16)26-27(21,24)25/h1-11,13H,14H2,(H2,21,24,25)