5-phenyl-1-[5-(phenylmethyl)-1,3-thiazol-2-yl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-phenyl-1-[5-(phenylmethyl)-1,3-thiazol-2-yl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(5-benzylthiazol-2-yl)-5-phenyl-triazole-4-carboxylic acid CAS Name: 5-phenyl-1-[5-(phenylmethyl)-2-thiazolyl]-4-triazolecarboxylic acid IUPAC Name: 1-(5-benzyl-1,3-thiazol-2-yl)-5-phenyltriazole-4-carboxylic acid Traditional Name: 1-(5-benzylthiazol-2-yl)-5-phenyl-triazole-4-carboxylic acid Formula: C19H14N4O2S MolecularWeight: 362.40506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CN=C(S2)N3C(=C(N=N3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CN=C(S2)N3C(=C(N=N3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C19H14N4O2S/c24-18(25)16-17(14-9-5-2-6-10-14)23(22-21-16)19-20-12-15(26-19)11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H,24,25)