[2-(diethylamino)-1,3-benzothiazol-6-yl] 3-fluoranylbenzoate

Systemtic Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 3-fluoranylbenzoate Openeye Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [2-(diethylamino)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [2-(diethylamino)-1,3-benzothiazol-6-yl] ester Formula: C18H17FN2O2S MolecularWeight: 344.403183

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC2=C(S1)C=C(C=C2)OC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCN(CC)C1=NC2=C(S1)C=C(C=C2)OC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H17FN2O2S/c1-3-21(4-2)18-20-15-9-8-14(11-16(15)24-18)23-17(22)12-6-5-7-13(19)10-12/h5-11H,3-4H2,1-2H3