4-[3,4-bis(fluoranyl)phenyl]-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid

Systemtic Name: 4-[3,4-bis(fluoranyl)phenyl]-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid Openeye Name: 4-(3,4-difluorophenyl)thiazol-2-amine; 4-methylbenzenesulfonic acid CAS Name: 4-(3,4-difluorophenyl)-2-thiazolamine; 4-methylbenzenesulfonic acid IUPAC Name: 4-(3,4-difluorophenyl)-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid Traditional Name: [4-(3,4-difluorophenyl)thiazol-2-yl]amine; tosylic acid Formula: C16H14F2N2O3S2 MolecularWeight: 384.420766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=C(C=C1C2=CSC(=N2)N)F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=C(C=C1C2=CSC(=N2)N)F)F

InChI

InChI=1S/C9H6F2N2S.C7H8O3S/c10-6-2-1-5(3-7(6)11)8-4-14-9(12)13-8;1-6-2-4-7(5-3-6)11(8,9)10/h1-4H,(H2,12,13);2-5H,1H3,(H,8,9,10)