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

Systemtic Name: N-(4-fluoranyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-(4-fluoro-3-propargyl-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-pyrazole-3-carboxamide Formula: C16H13FN4OS MolecularWeight: 328.364023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13FN4OS/c1-4-8-21-14-11(17)6-5-7-13(14)23-16(21)18-15(22)12-9-10(2)20(3)19-12/h1,5-7,9H,8H2,2-3H3