[[4-(4-chlorophenyl)-4,5-dihydro-1,3-thiazol-2-yl]-methylsulfanyl-phenyl-azaniumyl]methanoate

Systemtic Name: [[4-(4-chlorophenyl)-4,5-dihydro-1,3-thiazol-2-yl]-methylsulfanyl-phenyl-azaniumyl]methanoate Openeye Name: [[4-(4-chlorophenyl)-4,5-dihydrothiazol-2-yl]-methylsulfanyl-phenyl-ammonio]formate CAS Name: [[4-(4-chlorophenyl)-4,5-dihydrothiazol-2-yl]-(methylthio)-phenylammonio]formate IUPAC Name: [[4-(4-chlorophenyl)-4,5-dihydro-1,3-thiazol-2-yl]-methylsulfanyl-phenylazaniumyl]formate Traditional Name: [[4-(4-chlorophenyl)-2-thiazolin-2-yl]-(methylthio)-phenyl-ammonio]formate Formula: C17H15ClN2O2S2 MolecularWeight: 378.8962

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Descriptors Computed from Structure

Canonical SMILES:

CS[N+](C1=CC=CC=C1)(C2=NC(CS2)C3=CC=C(C=C3)Cl)C(=O)[O-]

Isomeric SMILES

CS[N+](C1=CC=CC=C1)(C2=NC(CS2)C3=CC=C(C=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C17H15ClN2O2S2/c1-23-20(17(21)22,14-5-3-2-4-6-14)16-19-15(11-24-16)12-7-9-13(18)10-8-12/h2-10,15H,11H2,1H3