methyl 3-[4-[1-(2-thiophen-3-ylethyl)imidazol-2-yl]piperidin-1-yl]sulfonylthiophene-2-carboxylate

Systemtic Name: methyl 3-[4-[1-(2-thiophen-3-ylethyl)imidazol-2-yl]piperidin-1-yl]sulfonylthiophene-2-carboxylate Openeye Name: methyl 3-[[4-[1-[2-(3-thienyl)ethyl]imidazol-2-yl]-1-piperidyl]sulfonyl]thiophene-2-carboxylate CAS Name: 3-[[4-[1-[2-(3-thiophenyl)ethyl]-2-imidazolyl]-1-piperidinyl]sulfonyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-[1-(2-thiophen-3-ylethyl)imidazol-2-yl]piperidin-1-yl]sulfonylthiophene-2-carboxylate Traditional Name: 3-[4-[1-[2-(3-thienyl)ethyl]imidazol-2-yl]piperidino]sulfonylthiophene-2-carboxylic acid methyl ester Formula: C20H23N3O4S3 MolecularWeight: 465.60932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)N2CCC(CC2)C3=NC=CN3CCC4=CSC=C4

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)N2CCC(CC2)C3=NC=CN3CCC4=CSC=C4

InChI

InChI=1S/C20H23N3O4S3/c1-27-20(24)18-17(6-13-29-18)30(25,26)23-9-3-16(4-10-23)19-21-7-11-22(19)8-2-15-5-12-28-14-15/h5-7,11-14,16H,2-4,8-10H2,1H3