diethyl 5-[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(4,5-dihydro-1H-imidazol-2-ylthio)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(2-imidazolin-2-ylthio)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C16H21N3O5S2 MolecularWeight: 399.48504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CSC2=NCCN2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CSC2=NCCN2

InChI

InChI=1S/C16H21N3O5S2/c1-4-23-14(21)11-9(3)12(15(22)24-5-2)26-13(11)19-10(20)8-25-16-17-6-7-18-16/h4-8H2,1-3H3,(H,17,18)(H,19,20)