2-cyanopropan-2-yl pyrrole-1-carbodithioate

Systemtic Name: 2-cyanopropan-2-yl pyrrole-1-carbodithioate Openeye Name: (1-cyano-1-methyl-ethyl) pyrrole-1-carbodithioate CAS Name: 1-pyrrolecarbodithioic acid 2-cyanopropan-2-yl ester IUPAC Name: 2-cyanopropan-2-yl pyrrole-1-carbodithioate Traditional Name: pyrrole-1-carbodithioic acid (1-cyano-1-methyl-ethyl) ester Formula: C9H10N2S2 MolecularWeight: 210.3191

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)SC(=S)N1C=CC=C1

Isomeric SMILES

CC(C)(C#N)SC(=S)N1C=CC=C1

InChI

InChI=1S/C9H10N2S2/c1-9(2,7-10)13-8(12)11-5-3-4-6-11/h3-6H,1-2H3