(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 1-[(4-fluorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 1-[(4-fluorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 1-[(4-fluorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-[(4-fluorophenyl)methyl]-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 1-[(4-fluorophenyl)methyl]-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(4-fluorobenzyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC(=O)N3CCCC3)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC(=O)N3CCCC3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C20H20FN3O3S/c1-13-16-10-17(20(26)27-12-18(25)23-8-2-3-9-23)28-19(16)24(22-13)11-14-4-6-15(21)7-5-14/h4-7,10H,2-3,8-9,11-12H2,1H3