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

Systemtic Name: N,N-bis(cyanomethyl)-2-propylsulfonyl-benzamide Openeye Name: N,N-bis(cyanomethyl)-2-propylsulfonyl-benzamide CAS Name: N,N-bis(cyanomethyl)-2-propylsulfonylbenzamide IUPAC Name: N,N-bis(cyanomethyl)-2-propylsulfonylbenzamide Traditional Name: N,N-bis(cyanomethyl)-2-propylsulfonyl-benzamide Formula: C14H15N3O3S MolecularWeight: 305.3522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O3S/c1-2-11-21(19,20)13-6-4-3-5-12(13)14(18)17(9-7-15)10-8-16/h3-6H,2,9-11H2,1H3