5-(5-chloranylthiophen-2-yl)-3-(1,2-oxazol-3-ylmethyl)-2-pyridin-3-yl-imidazole-4-carboxylic acid

Systemtic Name: 5-(5-chloranylthiophen-2-yl)-3-(1,2-oxazol-3-ylmethyl)-2-pyridin-3-yl-imidazole-4-carboxylic acid Openeye Name: 5-(5-chloro-2-thienyl)-3-(isoxazol-3-ylmethyl)-2-(3-pyridyl)imidazole-4-carboxylic acid CAS Name: 5-(5-chloro-2-thiophenyl)-3-(3-isoxazolylmethyl)-2-(3-pyridinyl)-4-imidazolecarboxylic acid IUPAC Name: 5-(5-chlorothiophen-2-yl)-3-(1,2-oxazol-3-ylmethyl)-2-pyridin-3-ylimidazole-4-carboxylic acid Traditional Name: 5-(5-chloro-2-thienyl)-3-(isoxazol-3-ylmethyl)-2-(3-pyridyl)imidazole-4-carboxylic acid Formula: C17H11ClN4O3S MolecularWeight: 386.81224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC(=C(N2CC3=NOC=C3)C(=O)O)C4=CC=C(S4)Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=NC(=C(N2CC3=NOC=C3)C(=O)O)C4=CC=C(S4)Cl

InChI

InChI=1S/C17H11ClN4O3S/c18-13-4-3-12(26-13)14-15(17(23)24)22(9-11-5-7-25-21-11)16(20-14)10-2-1-6-19-8-10/h1-8H,9H2,(H,23,24)