6-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-2-prop-1-ynyl-thieno[2,3-b]pyridine-5-carboxylic acid

Systemtic Name: 6-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-2-prop-1-ynyl-thieno[2,3-b]pyridine-5-carboxylic acid Openeye Name: 6-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-2-prop-1-ynyl-thieno[2,3-b]pyridine-5-carboxylic acid CAS Name: 6-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-2-prop-1-ynyl-5-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 6-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-2-prop-1-ynylthieno[2,3-b]pyridine-5-carboxylic acid Traditional Name: 6-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-2-prop-1-ynyl-thieno[2,3-b]pyridine-5-carboxylic acid Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC2=CC(=C(N=C2S1)C3=NC(C(=O)N3)(C)C(C)C)C(=O)O

Isomeric SMILES

CC#CC1=CC2=CC(=C(N=C2S1)C3=NC(C(=O)N3)(C)C(C)C)C(=O)O

InChI

InChI=1S/C18H17N3O3S/c1-5-6-11-7-10-8-12(16(22)23)13(19-15(10)25-11)14-20-17(24)18(4,21-14)9(2)3/h7-9H,1-4H3,(H,22,23)(H,20,21,24)