1-ethylsulfonyl-N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-ethylsulfonyl-N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide Openeye Name: 1-ethylsulfonyl-N-[5-[(4-fluorophenyl)methyl]thiazol-2-yl]piperidine-4-carboxamide CAS Name: 1-ethylsulfonyl-N-[5-[(4-fluorophenyl)methyl]-2-thiazolyl]-4-piperidinecarboxamide IUPAC Name: 1-ethylsulfonyl-N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide Traditional Name: 1-esyl-N-[5-(4-fluorobenzyl)thiazol-2-yl]isonipecotamide Formula: C18H22FN3O3S2 MolecularWeight: 411.513983

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN3O3S2/c1-2-27(24,25)22-9-7-14(8-10-22)17(23)21-18-20-12-16(26-18)11-13-3-5-15(19)6-4-13/h3-6,12,14H,2,7-11H2,1H3,(H,20,21,23)