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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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