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

Systemtic Name: 5-(5-chloranylthiophen-2-yl)-3-(1,2-oxazol-3-ylmethyl)-2-propan-2-yl-imidazole-4-carboxylic acid Openeye Name: 5-(5-chloro-2-thienyl)-2-isopropyl-3-(isoxazol-3-ylmethyl)imidazole-4-carboxylic acid CAS Name: 5-(5-chloro-2-thiophenyl)-3-(3-isoxazolylmethyl)-2-propan-2-yl-4-imidazolecarboxylic acid IUPAC Name: 5-(5-chlorothiophen-2-yl)-3-(1,2-oxazol-3-ylmethyl)-2-propan-2-ylimidazole-4-carboxylic acid Traditional Name: 5-(5-chloro-2-thienyl)-2-isopropyl-3-(isoxazol-3-ylmethyl)imidazole-4-carboxylic acid Formula: C15H14ClN3O3S MolecularWeight: 351.80796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=C(N1CC2=NOC=C2)C(=O)O)C3=CC=C(S3)Cl

Isomeric SMILES

CC(C)C1=NC(=C(N1CC2=NOC=C2)C(=O)O)C3=CC=C(S3)Cl

InChI

InChI=1S/C15H14ClN3O3S/c1-8(2)14-17-12(10-3-4-11(16)23-10)13(15(20)21)19(14)7-9-5-6-22-18-9/h3-6,8H,7H2,1-2H3,(H,20,21)