methyl 4-[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[3-(2-oxothiazolidin-3-yl)propanoylamino]-1H-pyrrole-2-carboxylate CAS Name: 4-[[1-oxo-3-(2-oxo-3-thiazolidinyl)propyl]amino]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[3-(2-oxo-1,3-thiazolidin-3-yl)propanoylamino]-1H-pyrrole-2-carboxylate Traditional Name: 4-[3-(2-ketothiazolidin-3-yl)propanoylamino]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C12H15N3O4S MolecularWeight: 297.3302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN1)NC(=O)CCN2CCSC2=O

Isomeric SMILES

COC(=O)C1=CC(=CN1)NC(=O)CCN2CCSC2=O

InChI

InChI=1S/C12H15N3O4S/c1-19-11(17)9-6-8(7-13-9)14-10(16)2-3-15-4-5-20-12(15)18/h6-7,13H,2-5H2,1H3,(H,14,16)