[4-[[(4-cyanophenyl)-pyrazin-2-yl-amino]methyl]phenyl] sulfamate

Systemtic Name: [4-[[(4-cyanophenyl)-pyrazin-2-yl-amino]methyl]phenyl] sulfamate Openeye Name: [4-[(4-cyano-N-pyrazin-2-yl-anilino)methyl]phenyl] sulfamate CAS Name: sulfamic acid [4-[[4-cyano-N-(2-pyrazinyl)anilino]methyl]phenyl] ester IUPAC Name: [4-[(4-cyano-N-pyrazin-2-ylanilino)methyl]phenyl] sulfamate Traditional Name: sulfamic acid [4-[(4-cyano-N-pyrazin-2-yl-anilino)methyl]phenyl] ester Formula: C18H15N5O3S MolecularWeight: 381.4084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN(C2=CC=C(C=C2)C#N)C3=NC=CN=C3)OS(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CN(C2=CC=C(C=C2)C#N)C3=NC=CN=C3)OS(=O)(=O)N

InChI

InChI=1S/C18H15N5O3S/c19-11-14-1-5-16(6-2-14)23(18-12-21-9-10-22-18)13-15-3-7-17(8-4-15)26-27(20,24)25/h1-10,12H,13H2,(H2,20,24,25)