2-(5-chloranylthiophen-2-yl)-4-(1,3-thiazol-4-ylmethyl)-5-thiophen-2-yl-pyrazole-3-carboxylic acid

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-4-(1,3-thiazol-4-ylmethyl)-5-thiophen-2-yl-pyrazole-3-carboxylic acid Openeye Name: 2-(5-chloro-2-thienyl)-4-(thiazol-4-ylmethyl)-5-(2-thienyl)pyrazole-3-carboxylic acid CAS Name: 2-(5-chloro-2-thiophenyl)-4-(4-thiazolylmethyl)-5-thiophen-2-yl-3-pyrazolecarboxylic acid IUPAC Name: 2-(5-chlorothiophen-2-yl)-4-(1,3-thiazol-4-ylmethyl)-5-thiophen-2-ylpyrazole-3-carboxylic acid Traditional Name: 2-(5-chloro-2-thienyl)-4-(thiazol-4-ylmethyl)-5-(2-thienyl)pyrazole-3-carboxylic acid Formula: C16H10ClN3O2S3 MolecularWeight: 407.9175

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NN(C(=C2CC3=CSC=N3)C(=O)O)C4=CC=C(S4)Cl

Isomeric SMILES

C1=CSC(=C1)C2=NN(C(=C2CC3=CSC=N3)C(=O)O)C4=CC=C(S4)Cl

InChI

InChI=1S/C16H10ClN3O2S3/c17-12-3-4-13(25-12)20-15(16(21)22)10(6-9-7-23-8-18-9)14(19-20)11-2-1-5-24-11/h1-5,7-8H,6H2,(H,21,22)