[(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl] 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl] 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl] 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(3-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid [(2R)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl] 1-(3-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid [(1R)-2-keto-1-methyl-2-pyrrolidino-ethyl] ester Formula: C20H20ClN3O3S MolecularWeight: 417.9091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OC(C)C(=O)N3CCCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)O[C@H](C)C(=O)N3CCCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H20ClN3O3S/c1-12-16-11-17(20(26)27-13(2)18(25)23-8-3-4-9-23)28-19(16)24(22-12)15-7-5-6-14(21)10-15/h5-7,10-11,13H,3-4,8-9H2,1-2H3/t13-/m1/s1