N-[4,6-bis(fluoranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-3-phenoxy-benzamide

Systemtic Name: N-[4,6-bis(fluoranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-3-phenoxy-benzamide Openeye Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenoxy-benzamide CAS Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenoxybenzamide IUPAC Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenoxybenzamide Traditional Name: N-(4,6-difluoro-3-propargyl-1,3-benzothiazol-2-ylidene)-3-phenoxy-benzamide Formula: C23H14F2N2O2S MolecularWeight: 420.431266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4)F)F

Isomeric SMILES

C#CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4)F)F

InChI

InChI=1S/C23H14F2N2O2S/c1-2-11-27-21-19(25)13-16(24)14-20(21)30-23(27)26-22(28)15-7-6-10-18(12-15)29-17-8-4-3-5-9-17/h1,3-10,12-14H,11H2