N-[[2,6-bis(fluoranyl)phenyl]methyl]-3-tert-butyl-1-cyclopentyl-pyrazole-4-sulfonamide

Systemtic Name: N-[[2,6-bis(fluoranyl)phenyl]methyl]-3-tert-butyl-1-cyclopentyl-pyrazole-4-sulfonamide Openeye Name: 3-tert-butyl-1-cyclopentyl-N-[(2,6-difluorophenyl)methyl]pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-1-cyclopentyl-N-[(2,6-difluorophenyl)methyl]-4-pyrazolesulfonamide IUPAC Name: 3-tert-butyl-1-cyclopentyl-N-[(2,6-difluorophenyl)methyl]pyrazole-4-sulfonamide Traditional Name: 3-tert-butyl-1-cyclopentyl-N-(2,6-difluorobenzyl)pyrazole-4-sulfonamide Formula: C19H25F2N3O2S MolecularWeight: 397.482506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCC2=C(C=CC=C2F)F)C3CCCC3

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCC2=C(C=CC=C2F)F)C3CCCC3

InChI

InChI=1S/C19H25F2N3O2S/c1-19(2,3)18-17(12-24(23-18)13-7-4-5-8-13)27(25,26)22-11-14-15(20)9-6-10-16(14)21/h6,9-10,12-13,22H,4-5,7-8,11H2,1-3H3