dimethyl 5-[3-[furan-2-ylmethyl(methyl)amino]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[3-[furan-2-ylmethyl(methyl)amino]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[3-[2-furylmethyl(methyl)amino]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[3-[2-furanylmethyl(methyl)amino]-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-[furan-2-ylmethyl(methyl)amino]propanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-[2-furfuryl(methyl)amino]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCN(C)CC2=CC=CO2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCN(C)CC2=CC=CO2)C(=O)OC

InChI

InChI=1S/C18H22N2O6S/c1-11-14(17(22)24-3)16(27-15(11)18(23)25-4)19-13(21)7-8-20(2)10-12-6-5-9-26-12/h5-6,9H,7-8,10H2,1-4H3,(H,19,21)