dimethyl 3-methyl-5-[2-(prop-2-ynylamino)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-(prop-2-ynylamino)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(prop-2-ynylamino)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(prop-2-ynylamino)ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(prop-2-ynylamino)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(propargylamino)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C14H16N2O5S MolecularWeight: 324.35224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CNCC#C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CNCC#C)C(=O)OC

InChI

InChI=1S/C14H16N2O5S/c1-5-6-15-7-9(17)16-12-10(13(18)20-3)8(2)11(22-12)14(19)21-4/h1,15H,6-7H2,2-4H3,(H,16,17)