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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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