(2-morpholin-4-yl-1,3-benzothiazol-6-yl) 4-bromanylbenzoate

Systemtic Name: (2-morpholin-4-yl-1,3-benzothiazol-6-yl) 4-bromanylbenzoate Openeye Name: (2-morpholino-1,3-benzothiazol-6-yl) 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(4-morpholinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: (2-morpholin-4-yl-1,3-benzothiazol-6-yl) 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (2-morpholino-1,3-benzothiazol-6-yl) ester Formula: C18H15BrN2O3S MolecularWeight: 419.2923

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H15BrN2O3S/c19-13-3-1-12(2-4-13)17(22)24-14-5-6-15-16(11-14)25-18(20-15)21-7-9-23-10-8-21/h1-6,11H,7-10H2