(1-cyanoindolizin-2-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CN4C=CC=CC4=C3C#N)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CN4C=CC=CC4=C3C#N)C

InChI

InChI=1S/C18H14N4O2S/c1-11-13-7-16(25-17(13)21(2)20-11)18(23)24-10-12-9-22-6-4-3-5-15(22)14(12)8-19/h3-7,9H,10H2,1-2H3