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

Systemtic Name: ethyl 4-(furan-2-yl)-2-(2-morpholin-4-ylcarbothioylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(2-furyl)-2-[[2-(morpholine-4-carbothioylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-furanyl)-2-[[2-[[4-morpholinyl(sulfanylidene)methyl]thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(furan-2-yl)-2-[[2-(morpholine-4-carbothioylsulfanyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(2-furyl)-2-[[2-(morpholine-4-carbothioylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H20N2O5S3 MolecularWeight: 440.5568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC(=S)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC(=S)N3CCOCC3

InChI

InChI=1S/C18H20N2O5S3/c1-2-24-17(22)15-12(13-4-3-7-25-13)10-27-16(15)19-14(21)11-28-18(26)20-5-8-23-9-6-20/h3-4,7,10H,2,5-6,8-9,11H2,1H3,(H,19,21)