2-(6-fluoranyl-2-oxidanylidene-3-prop-2-ynyl-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(6-fluoranyl-2-oxidanylidene-3-prop-2-ynyl-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-(6-fluoro-2-oxo-3-prop-2-ynyl-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-(6-fluoro-2-oxo-3-prop-2-ynyl-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(6-fluoro-2-oxo-3-prop-2-ynyl-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-(6-fluoro-2-keto-3-propargyl-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C18H13FN2O3S MolecularWeight: 356.370823

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=CC(=C(C=C2SC1=O)F)N3C(=O)C4=C(C3=O)CCCC4

Isomeric SMILES

C#CCN1C2=CC(=C(C=C2SC1=O)F)N3C(=O)C4=C(C3=O)CCCC4

InChI

InChI=1S/C18H13FN2O3S/c1-2-7-20-14-9-13(12(19)8-15(14)25-18(20)24)21-16(22)10-5-3-4-6-11(10)17(21)23/h1,8-9H,3-7H2