N,N-bis(2-cyanoethyl)-2-propylsulfonyl-benzamide

Systemtic Name: N,N-bis(2-cyanoethyl)-2-propylsulfonyl-benzamide Openeye Name: N,N-bis(2-cyanoethyl)-2-propylsulfonyl-benzamide CAS Name: N,N-bis(2-cyanoethyl)-2-propylsulfonylbenzamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-propylsulfonylbenzamide Traditional Name: N,N-bis(2-cyanoethyl)-2-propylsulfonyl-benzamide Formula: C16H19N3O3S MolecularWeight: 333.40536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCC#N)CCC#N

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C16H19N3O3S/c1-2-13-23(21,22)15-8-4-3-7-14(15)16(20)19(11-5-9-17)12-6-10-18/h3-4,7-8H,2,5-6,11-13H2,1H3