ethyl 4-aminocarbonyl-2-methyl-5-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)furan-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-2-methyl-5-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)furan-3-carboxylate Openeye Name: ethyl 4-carbamoyl-2-methyl-5-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]furan-3-carboxylate CAS Name: 4-carbamoyl-2-methyl-5-[[1-oxo-2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]ethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-2-methyl-5-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]furan-3-carboxylate Traditional Name: 4-carbamoyl-2-methyl-5-[[2-(pyrrolidine-1-carbothioylthio)acetyl]amino]furan-3-carboxylic acid ethyl ester Formula: C16H21N3O5S2 MolecularWeight: 399.48504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CSC(=S)N2CCCC2)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CSC(=S)N2CCCC2)C

InChI

InChI=1S/C16H21N3O5S2/c1-3-23-15(22)11-9(2)24-14(12(11)13(17)21)18-10(20)8-26-16(25)19-6-4-5-7-19/h3-8H2,1-2H3,(H2,17,21)(H,18,20)