1-oxidanylidene-7-propan-2-yl-pyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid

Systemtic Name: 1-oxidanylidene-7-propan-2-yl-pyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid Openeye Name: 7-isopropyl-1-oxo-pyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid CAS Name: 1-oxo-7-propan-2-yl-4-pyrimido[6,1-b][1,3]benzothiazolecarboxylic acid IUPAC Name: 1-oxo-7-propan-2-ylpyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid Traditional Name: 7-isopropyl-1-keto-pyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid Formula: C14H12N2O3S MolecularWeight: 288.32168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N3C(=C(C=NC3=O)C(=O)O)S2

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N3C(=C(C=NC3=O)C(=O)O)S2

InChI

InChI=1S/C14H12N2O3S/c1-7(2)8-3-4-10-11(5-8)20-12-9(13(17)18)6-15-14(19)16(10)12/h3-7H,1-2H3,(H,17,18)