4-(1,3-benzoxazol-2-ylsulfanylmethyl)-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-(1,3-benzoxazol-2-ylsulfanylmethyl)-1,3-thiazole-2-carboxylic acid Openeye Name: 4-(1,3-benzoxazol-2-ylsulfanylmethyl)thiazole-2-carboxylic acid CAS Name: 4-[(1,3-benzoxazol-2-ylthio)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-(1,3-benzoxazol-2-ylsulfanylmethyl)-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(1,3-benzoxazol-2-ylthio)methyl]thiazole-2-carboxylic acid Formula: C12H8N2O3S2 MolecularWeight: 292.33352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC3=CSC(=N3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C12H8N2O3S2/c15-11(16)10-13-7(5-18-10)6-19-12-14-8-3-1-2-4-9(8)17-12/h1-5H,6H2,(H,15,16)