N,3-diethyl-4-phenyl-3H-1,3-thiazol-3-ium-2-imine perchlorate

Systemtic Name: N,3-diethyl-4-phenyl-3H-1,3-thiazol-3-ium-2-imine perchlorate Openeye Name: N,3-diethyl-4-phenyl-3H-thiazol-3-ium-2-imine perchlorate CAS Name: N,3-diethyl-4-phenyl-3H-thiazol-3-ium-2-imine perchlorate IUPAC Name: N,3-diethyl-4-phenyl-3H-1,3-thiazol-3-ium-2-imine perchlorate Traditional Name: ethyl-(3-ethyl-4-phenyl-4-thiazolin-3-ium-2-ylidene)amine perchlorate Formula: C13H17ClN2O4S MolecularWeight: 332.80308

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C1[NH+](C(=CS1)C2=CC=CC=C2)CC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCN=C1[NH+](C(=CS1)C2=CC=CC=C2)CC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H16N2S.ClHO4/c1-3-14-13-15(4-2)12(10-16-13)11-8-6-5-7-9-11;2-1(3,4)5/h5-10H,3-4H2,1-2H3;(H,2,3,4,5)