methyl 3-oxidanylidene-3-(2-phenylpyrrolo[2,1-b][1,3]benzothiazol-3-yl)propanoate

Systemtic Name: methyl 3-oxidanylidene-3-(2-phenylpyrrolo[2,1-b][1,3]benzothiazol-3-yl)propanoate Openeye Name: methyl 3-oxo-3-(2-phenylpyrrolo[2,1-b][1,3]benzothiazol-3-yl)propanoate CAS Name: 3-oxo-3-(2-phenyl-3-pyrrolo[2,1-b][1,3]benzothiazolyl)propanoic acid methyl ester IUPAC Name: methyl 3-oxo-3-(2-phenylpyrrolo[2,1-b][1,3]benzothiazol-3-yl)propanoate Traditional Name: 3-keto-3-(2-phenylpyrrolo[2,1-b][1,3]benzothiazol-3-yl)propionic acid methyl ester Formula: C20H15NO3S MolecularWeight: 349.403

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)C1=C2N(C=C1C3=CC=CC=C3)C4=CC=CC=C4S2

Isomeric SMILES

COC(=O)CC(=O)C1=C2N(C=C1C3=CC=CC=C3)C4=CC=CC=C4S2

InChI

InChI=1S/C20H15NO3S/c1-24-18(23)11-16(22)19-14(13-7-3-2-4-8-13)12-21-15-9-5-6-10-17(15)25-20(19)21/h2-10,12H,11H2,1H3