(2,4-dimethylphenyl) 3-piperidin-1-ylsulfonylthiophene-2-carboxylate

Systemtic Name: (2,4-dimethylphenyl) 3-piperidin-1-ylsulfonylthiophene-2-carboxylate Openeye Name: (2,4-dimethylphenyl) 3-(1-piperidylsulfonyl)thiophene-2-carboxylate CAS Name: 3-(1-piperidinylsulfonyl)-2-thiophenecarboxylic acid (2,4-dimethylphenyl) ester IUPAC Name: (2,4-dimethylphenyl) 3-piperidin-1-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-piperidinosulfonylthiophene-2-carboxylic acid (2,4-dimethylphenyl) ester Formula: C18H21NO4S2 MolecularWeight: 379.49364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C18H21NO4S2/c1-13-6-7-15(14(2)12-13)23-18(20)17-16(8-11-24-17)25(21,22)19-9-4-3-5-10-19/h6-8,11-12H,3-5,9-10H2,1-2H3