N-[4-[2,6-bis(fluoranyl)phenyl]-1,3-thiazol-2-yl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-[2,6-bis(fluoranyl)phenyl]-1,3-thiazol-2-yl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[4-(2,6-difluorophenyl)thiazol-2-yl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[4-(2,6-difluorophenyl)-2-thiazolyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[4-(2,6-difluorophenyl)-1,3-thiazol-2-yl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[4-(2,6-difluorophenyl)thiazol-2-yl]-1-propylsulfonyl-nipecotamide Formula: C18H21F2N3O3S2 MolecularWeight: 429.504446

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=NC(=CS2)C3=C(C=CC=C3F)F

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=NC(=CS2)C3=C(C=CC=C3F)F

InChI

InChI=1S/C18H21F2N3O3S2/c1-2-9-28(25,26)23-8-4-5-12(10-23)17(24)22-18-21-15(11-27-18)16-13(19)6-3-7-14(16)20/h3,6-7,11-12H,2,4-5,8-10H2,1H3,(H,21,22,24)