4-chloranyl-2-fluoranyl-benzenesulfonic acid; 4-(4-phenylphenyl)-1,3-thiazol-2-amine

Systemtic Name: 4-chloranyl-2-fluoranyl-benzenesulfonic acid; 4-(4-phenylphenyl)-1,3-thiazol-2-amine Openeye Name: 4-chloro-2-fluoro-benzenesulfonic acid; 4-(4-phenylphenyl)thiazol-2-amine CAS Name: 4-chloro-2-fluorobenzenesulfonic acid; 4-(4-phenylphenyl)-2-thiazolamine IUPAC Name: 4-chloro-2-fluorobenzenesulfonic acid; 4-(4-phenylphenyl)-1,3-thiazol-2-amine Traditional Name: 4-chloro-2-fluoro-besylic acid; [4-(4-phenylphenyl)thiazol-2-yl]amine Formula: C21H16ClFN2O3S2 MolecularWeight: 462.944743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC(=N3)N.C1=CC(=C(C=C1Cl)F)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC(=N3)N.C1=CC(=C(C=C1Cl)F)S(=O)(=O)O

InChI

InChI=1S/C15H12N2S.C6H4ClFO3S/c16-15-17-14(10-18-15)13-8-6-12(7-9-13)11-4-2-1-3-5-11;7-4-1-2-6(5(8)3-4)12(9,10)11/h1-10H,(H2,16,17);1-3H,(H,9,10,11)