N,N-bis(cyanomethyl)-3-(phenylsulfonyl)propanamide

Systemtic Name: N,N-bis(cyanomethyl)-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N,N-bis(cyanomethyl)propanamide CAS Name: 3-(benzenesulfonyl)-N,N-bis(cyanomethyl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N,N-bis(cyanomethyl)propanamide Traditional Name: 3-besyl-N,N-bis(cyanomethyl)propionamide Formula: C13H13N3O3S MolecularWeight: 291.32562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC#N)CC#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC#N)CC#N

InChI

InChI=1S/C13H13N3O3S/c14-7-9-16(10-8-15)13(17)6-11-20(18,19)12-4-2-1-3-5-12/h1-5H,6,9-11H2