1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-4-cyano-5-thiophen-2-yl-pyrazole-3-carboxylic acid

Systemtic Name: 1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-4-cyano-5-thiophen-2-yl-pyrazole-3-carboxylic acid Openeye Name: 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-4-cyano-5-(2-thienyl)pyrazole-3-carboxylic acid CAS Name: 1-[[5-(5-chloro-2-thiophenyl)-3-isoxazolyl]methyl]-4-cyano-5-thiophen-2-yl-3-pyrazolecarboxylic acid IUPAC Name: 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-4-cyano-5-thiophen-2-ylpyrazole-3-carboxylic acid Traditional Name: 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-4-cyano-5-(2-thienyl)pyrazole-3-carboxylic acid Formula: C17H9ClN4O3S2 MolecularWeight: 416.86136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C(C(=NN2CC3=NOC(=C3)C4=CC=C(S4)Cl)C(=O)O)C#N

Isomeric SMILES

C1=CSC(=C1)C2=C(C(=NN2CC3=NOC(=C3)C4=CC=C(S4)Cl)C(=O)O)C#N

InChI

InChI=1S/C17H9ClN4O3S2/c18-14-4-3-12(27-14)11-6-9(21-25-11)8-22-16(13-2-1-5-26-13)10(7-19)15(20-22)17(23)24/h1-6H,8H2,(H,23,24)