methyl 5-ethyl-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propylcarbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-ethyl-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propylcarbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[3-(2-oxopyrrolidin-1-yl)propylcarbamothioylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[3-(2-oxo-1-pyrrolidinyl)propylamino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[3-(2-oxopyrrolidin-1-yl)propylcarbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[3-(2-ketopyrrolidino)propylthiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C16H23N3O3S2 MolecularWeight: 369.50212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NCCCN2CCCC2=O)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NCCCN2CCCC2=O)C(=O)OC

InChI

InChI=1S/C16H23N3O3S2/c1-3-11-10-12(15(21)22-2)14(24-11)18-16(23)17-7-5-9-19-8-4-6-13(19)20/h10H,3-9H2,1-2H3,(H2,17,18,23)