N-(cyanomethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(cyanomethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(cyanomethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(cyanomethyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(cyanomethyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(cyanomethyl)-3-pyrrolidinosulfonyl-benzamide Formula: C13H15N3O3S MolecularWeight: 293.3415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC#N

InChI

InChI=1S/C13H15N3O3S/c14-6-7-15-13(17)11-4-3-5-12(10-11)20(18,19)16-8-1-2-9-16/h3-5,10H,1-2,7-9H2,(H,15,17)