phenyl N-[[(4-cyanophenyl)-pyrazol-1-yl-amino]methyl]sulfamate

Systemtic Name: phenyl N-[[(4-cyanophenyl)-pyrazol-1-yl-amino]methyl]sulfamate Openeye Name: phenyl N-[(4-cyano-N-pyrazol-1-yl-anilino)methyl]sulfamate CAS Name: N-[[4-cyano-N-(1-pyrazolyl)anilino]methyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[(4-cyano-N-pyrazol-1-ylanilino)methyl]sulfamate Traditional Name: N-[(4-cyano-N-pyrazol-1-yl-anilino)methyl]sulfamic acid phenyl ester Formula: C17H15N5O3S MolecularWeight: 369.3977

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)NCN(C2=CC=C(C=C2)C#N)N3C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)NCN(C2=CC=C(C=C2)C#N)N3C=CC=N3

InChI

InChI=1S/C17H15N5O3S/c18-13-15-7-9-16(10-8-15)21(22-12-4-11-19-22)14-20-26(23,24)25-17-5-2-1-3-6-17/h1-12,20H,14H2