N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-2-ethyl-N-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-2-ethyl-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-ethyl-pyrazole-3-carboxamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-ethyl-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-ethylpyrazole-3-carboxamide Traditional Name: N-benzyl-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-ethyl-pyrazole-3-carboxamide Formula: C20H16F2N4OS MolecularWeight: 398.429046

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=C(C=C4S3)F)F

Isomeric SMILES

CCN1C(=CC=N1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=C(C=C4S3)F)F

InChI

InChI=1S/C20H16F2N4OS/c1-2-26-16(8-9-23-26)19(27)25(12-13-6-4-3-5-7-13)20-24-18-15(22)10-14(21)11-17(18)28-20/h3-11H,2,12H2,1H3