ethyl 4-(furan-2-yl)-2-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(furan-2-yl)-2-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(2-furyl)-2-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-furanyl)-2-[[1-oxo-2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(furan-2-yl)-2-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(2-furyl)-2-[[2-(pyrrolidine-1-carbothioylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H20N2O4S3 MolecularWeight: 424.5574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC(=S)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC(=S)N3CCCC3

InChI

InChI=1S/C18H20N2O4S3/c1-2-23-17(22)15-12(13-6-5-9-24-13)10-26-16(15)19-14(21)11-27-18(25)20-7-3-4-8-20/h5-6,9-10H,2-4,7-8,11H2,1H3,(H,19,21)