ethyl 2,4-dimethyl-5-thiocyanato-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-thiocyanato-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-thiocyanato-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-thiocyanato-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-thiocyanato-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-thiocyanato-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C10H12N2O2S MolecularWeight: 224.27948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)SC#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)SC#N)C

InChI

InChI=1S/C10H12N2O2S/c1-4-14-10(13)8-6(2)9(15-5-11)12-7(8)3/h12H,4H2,1-3H3