ethyl 5-ethyl-2-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(pyrrolidine-1-carbothioylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C16H22N2O3S3 MolecularWeight: 386.55248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CSC(=S)N2CCCC2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CSC(=S)N2CCCC2)C(=O)OCC

InChI

InChI=1S/C16H22N2O3S3/c1-3-11-9-12(15(20)21-4-2)14(24-11)17-13(19)10-23-16(22)18-7-5-6-8-18/h9H,3-8,10H2,1-2H3,(H,17,19)