[2-(diethylamino)-1,3-benzothiazol-6-yl] 4-cyanobenzoate

Systemtic Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 4-cyanobenzoate Openeye Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(diethylamino)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(diethylamino)-1,3-benzothiazol-6-yl] ester Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O2S/c1-3-22(4-2)19-21-16-10-9-15(11-17(16)25-19)24-18(23)14-7-5-13(12-20)6-8-14/h5-11H,3-4H2,1-2H3