methyl 3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]sulfonylthiophene-2-carboxylate

Systemtic Name: methyl 3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]sulfonylthiophene-2-carboxylate Openeye Name: methyl 3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]sulfonylthiophene-2-carboxylate CAS Name: 3-[[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]sulfonyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]sulfonylthiophene-2-carboxylate Traditional Name: 3-(4-p-anisylpiperazino)sulfonylthiophene-2-carboxylic acid methyl ester Formula: C18H22N2O5S2 MolecularWeight: 410.50768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=C(SC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C18H22N2O5S2/c1-24-15-5-3-14(4-6-15)13-19-8-10-20(11-9-19)27(22,23)16-7-12-26-17(16)18(21)25-2/h3-7,12H,8-11,13H2,1-2H3