N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C25H27FN2O3S2 MolecularWeight: 486.621883

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H27FN2O3S2/c1-2-18-9-11-19(12-10-18)24(22-7-5-17-32-22)27-25(29)20-13-15-28(16-14-20)33(30,31)23-8-4-3-6-21(23)26/h3-12,17,20,24H,2,13-16H2,1H3,(H,27,29)