ethyl 2-[4-(4-fluorophenyl)sulfonyl-1-[(5-methylthiophen-2-yl)methyl]piperidin-4-yl]ethanoate

Systemtic Name: ethyl 2-[4-(4-fluorophenyl)sulfonyl-1-[(5-methylthiophen-2-yl)methyl]piperidin-4-yl]ethanoate Openeye Name: ethyl 2-[4-(4-fluorophenyl)sulfonyl-1-[(5-methyl-2-thienyl)methyl]-4-piperidyl]acetate CAS Name: 2-[4-(4-fluorophenyl)sulfonyl-1-[(5-methyl-2-thiophenyl)methyl]-4-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-fluorophenyl)sulfonyl-1-[(5-methylthiophen-2-yl)methyl]piperidin-4-yl]acetate Traditional Name: 2-[4-(4-fluorophenyl)sulfonyl-1-[(5-methyl-2-thienyl)methyl]-4-piperidyl]acetic acid ethyl ester Formula: C21H26FNO4S2 MolecularWeight: 439.563843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CCN(CC1)CC2=CC=C(S2)C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)CC1(CCN(CC1)CC2=CC=C(S2)C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FNO4S2/c1-3-27-20(24)14-21(29(25,26)19-8-5-17(22)6-9-19)10-12-23(13-11-21)15-18-7-4-16(2)28-18/h4-9H,3,10-15H2,1-2H3