2-[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-N-pentan-2-yl-ethanamide

Systemtic Name: 2-[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-N-pentan-2-yl-ethanamide Openeye Name: 2-[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]-N-(1-methylbutyl)acetamide CAS Name: 2-[4-(3,4-difluorophenyl)sulfonyl-1-piperazinyl]-N-pentan-2-ylacetamide IUPAC Name: 2-[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]-N-pentan-2-ylacetamide Traditional Name: 2-[4-(3,4-difluorophenyl)sulfonylpiperazino]-N-(1-methylbutyl)acetamide Formula: C17H25F2N3O3S MolecularWeight: 389.460506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

CCCC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C17H25F2N3O3S/c1-3-4-13(2)20-17(23)12-21-7-9-22(10-8-21)26(24,25)14-5-6-15(18)16(19)11-14/h5-6,11,13H,3-4,7-10,12H2,1-2H3,(H,20,23)