N-[4,6-bis(fluoranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-(4,6-difluoro-3-propargyl-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-pyrazole-3-carboxamide Formula: C16H12F2N4OS MolecularWeight: 346.354486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N=C2N(C3=C(C=C(C=C3S2)F)F)CC#C

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N=C2N(C3=C(C=C(C=C3S2)F)F)CC#C

InChI

InChI=1S/C16H12F2N4OS/c1-4-5-22-14-11(18)7-10(17)8-13(14)24-16(22)19-15(23)12-6-9(2)21(3)20-12/h1,6-8H,5H2,2-3H3