(3-morpholin-4-ylsulfonylphenyl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C19H21N3O5S2 MolecularWeight: 435.51714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C19H21N3O5S2/c1-13-16-11-17(28-18(16)21(2)20-13)19(23)27-12-14-4-3-5-15(10-14)29(24,25)22-6-8-26-9-7-22/h3-5,10-11H,6-9,12H2,1-2H3