O2-methyl O4-propyl 3-methyl-5-[[5-(piperidin-1-ylmethyl)furan-2-yl]carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O2-methyl O4-propyl 3-methyl-5-[[5-(piperidin-1-ylmethyl)furan-2-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-methyl O4-propyl 3-methyl-5-[[5-(1-piperidylmethyl)furan-2-carbonyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[5-(1-piperidinylmethyl)-2-furanyl]methyl]amino]thiophene-2,4-dicarboxylic acid O2-methyl ester O4-propyl ester IUPAC Name: 2-O-methyl 4-O-propyl 3-methyl-5-[[5-(piperidin-1-ylmethyl)furan-2-carbonyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[5-(piperidinomethyl)-2-furoyl]amino]thiophene-2,4-dicarboxylic acid O2-methyl ester O4-propyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=CC=C(O2)CN3CCCCC3

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=CC=C(O2)CN3CCCCC3

InChI

InChI=1S/C22H28N2O6S/c1-4-12-29-21(26)17-14(2)18(22(27)28-3)31-20(17)23-19(25)16-9-8-15(30-16)13-24-10-6-5-7-11-24/h8-9H,4-7,10-13H2,1-3H3,(H,23,25)