2-(2-oxidanylidene-4-phenyl-pyrimido[2,1-b][1,3]benzothiazol-8-yl)propanoic acid

Systemtic Name: 2-(2-oxidanylidene-4-phenyl-pyrimido[2,1-b][1,3]benzothiazol-8-yl)propanoic acid Openeye Name: 2-(2-oxo-4-phenyl-pyrimido[2,1-b][1,3]benzothiazol-8-yl)propanoic acid CAS Name: 2-(2-oxo-4-phenyl-8-pyrimido[2,1-b][1,3]benzothiazolyl)propanoic acid IUPAC Name: 2-(2-oxo-4-phenylpyrimido[2,1-b][1,3]benzothiazol-8-yl)propanoic acid Traditional Name: 2-(2-keto-4-phenyl-pyrimido[2,1-b][1,3]benzothiazol-8-yl)propionic acid Formula: C19H14N2O3S MolecularWeight: 350.39106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)N3C(=CC(=O)N=C3S2)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)N3C(=CC(=O)N=C3S2)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C19H14N2O3S/c1-11(18(23)24)13-7-8-14-16(9-13)25-19-20-17(22)10-15(21(14)19)12-5-3-2-4-6-12/h2-11H,1H3,(H,23,24)