(1-cyanoindolizin-2-yl)methyl 5-(furan-2-ylcarbonylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 5-(furan-2-ylcarbonylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 5-(furan-2-carbonylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-furanyl(oxo)methyl]amino]-3-methyl-2-thiophenecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 5-(furan-2-carbonylamino)-3-methylthiophene-2-carboxylate Traditional Name: 5-(2-furoylamino)-3-methyl-thiophene-2-carboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=CC=CO2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=CC=CO2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C21H15N3O4S/c1-13-9-18(23-20(25)17-6-4-8-27-17)29-19(13)21(26)28-12-14-11-24-7-3-2-5-16(24)15(14)10-22/h2-9,11H,12H2,1H3,(H,23,25)