1-(6-chloranylpyridazin-3-yl)-3-propan-2-yl-thieno[2,3-c]pyrazole-5-carboxylic acid

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-3-propan-2-yl-thieno[2,3-c]pyrazole-5-carboxylic acid Openeye Name: 1-(6-chloropyridazin-3-yl)-3-isopropyl-thieno[2,3-c]pyrazole-5-carboxylic acid CAS Name: 1-(6-chloro-3-pyridazinyl)-3-propan-2-yl-5-thieno[2,3-c]pyrazolecarboxylic acid IUPAC Name: 1-(6-chloropyridazin-3-yl)-3-propan-2-ylthieno[2,3-c]pyrazole-5-carboxylic acid Traditional Name: 1-(6-chloropyridazin-3-yl)-3-isopropyl-thieno[2,3-c]pyrazole-5-carboxylic acid Formula: C13H11ClN4O2S MolecularWeight: 322.77004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C2=C1C=C(S2)C(=O)O)C3=NN=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=NN(C2=C1C=C(S2)C(=O)O)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C13H11ClN4O2S/c1-6(2)11-7-5-8(13(19)20)21-12(7)18(17-11)10-4-3-9(14)15-16-10/h3-6H,1-2H3,(H,19,20)