[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: [1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid [2-keto-1-methyl-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(C)OC(=O)C2=CC3=C(S2)N(N=C3C)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)C(C)OC(=O)C2=CC3=C(S2)N(N=C3C)C)C)C

InChI

InChI=1S/C20H22N2O3S/c1-10-7-12(3)15(8-11(10)2)18(23)14(5)25-20(24)17-9-16-13(4)21-22(6)19(16)26-17/h7-9,14H,1-6H3