[3-chloranyl-4-(pyrrolidin-1-ylsulfonylamino)phenyl] thiocyanate

Systemtic Name: [3-chloranyl-4-(pyrrolidin-1-ylsulfonylamino)phenyl] thiocyanate Openeye Name: [3-chloro-4-(pyrrolidin-1-ylsulfonylamino)phenyl] thiocyanate CAS Name: thiocyanic acid [3-chloro-4-(1-pyrrolidinylsulfonylamino)phenyl] ester IUPAC Name: [3-chloro-4-(pyrrolidin-1-ylsulfonylamino)phenyl] thiocyanate Traditional Name: thiocyanic acid [3-chloro-4-(pyrrolidinosulfonylamino)phenyl] ester Formula: C11H12ClN3O2S2 MolecularWeight: 317.81488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)Cl

InChI

InChI=1S/C11H12ClN3O2S2/c12-10-7-9(18-8-13)3-4-11(10)14-19(16,17)15-5-1-2-6-15/h3-4,7,14H,1-2,5-6H2