8-methyl-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid

Systemtic Name: 8-methyl-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid Openeye Name: 8-methyl-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid CAS Name: 8-methyl-4-oxo-3-pyrimido[2,1-b][1,3]benzothiazolecarboxylic acid IUPAC Name: 8-methyl-4-oxopyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid Traditional Name: 4-keto-8-methyl-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid Formula: C12H8N2O3S MolecularWeight: 260.26852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N3C(=O)C(=CN=C3S2)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N3C(=O)C(=CN=C3S2)C(=O)O

InChI

InChI=1S/C12H8N2O3S/c1-6-2-3-8-9(4-6)18-12-13-5-7(11(16)17)10(15)14(8)12/h2-5H,1H3,(H,16,17)