phenyl N-[[(4-cyanophenyl)-(thiophen-2-ylmethyl)amino]methyl]sulfamate

Systemtic Name: phenyl N-[[(4-cyanophenyl)-(thiophen-2-ylmethyl)amino]methyl]sulfamate Openeye Name: phenyl N-[[4-cyano-N-(2-thienylmethyl)anilino]methyl]sulfamate CAS Name: N-[[4-cyano-N-(thiophen-2-ylmethyl)anilino]methyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[[4-cyano-N-(thiophen-2-ylmethyl)anilino]methyl]sulfamate Traditional Name: N-[[4-cyano-N-(2-thenyl)anilino]methyl]sulfamic acid phenyl ester Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)NCN(CC2=CC=CS2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)NCN(CC2=CC=CS2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H17N3O3S2/c20-13-16-8-10-17(11-9-16)22(14-19-7-4-12-26-19)15-21-27(23,24)25-18-5-2-1-3-6-18/h1-12,21H,14-15H2