1-[3-(4-fluorophenyl)sulfanylpropanoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[3-(4-fluorophenyl)sulfanylpropanoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[3-(4-fluorophenyl)sulfanylpropanoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[3-[(4-fluorophenyl)thio]-1-oxopropyl]-N-(2-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-(4-fluorophenyl)sulfanylpropanoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[3-[(4-fluorophenyl)thio]propanoyl]-N-(2-methoxyphenyl)isonipecotamide Formula: C22H25FN2O3S MolecularWeight: 416.508903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN2O3S/c1-28-20-5-3-2-4-19(20)24-22(27)16-10-13-25(14-11-16)21(26)12-15-29-18-8-6-17(23)7-9-18/h2-9,16H,10-15H2,1H3,(H,24,27)