2-imidazol-1-ylcarbothioyloxy-2-phenyl-ethanoic acid

Systemtic Name: 2-imidazol-1-ylcarbothioyloxy-2-phenyl-ethanoic acid Openeye Name: 2-(imidazole-1-carbothioyloxy)-2-phenyl-acetic acid CAS Name: 2-[1-imidazolyl(sulfanylidene)methoxy]-2-phenylacetic acid IUPAC Name: 2-(imidazole-1-carbothioyloxy)-2-phenylacetic acid Traditional Name: 2-(imidazole-1-carbothioyloxy)-2-phenyl-acetic acid Formula: C12H10N2O3S MolecularWeight: 262.2844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)OC(=S)N2C=CN=C2

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)OC(=S)N2C=CN=C2

InChI

InChI=1S/C12H10N2O3S/c15-11(16)10(9-4-2-1-3-5-9)17-12(18)14-7-6-13-8-14/h1-8,10H,(H,15,16)