4-[2-(cyclohexen-1-yl)ethynyl]-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid

Systemtic Name: 4-[2-(cyclohexen-1-yl)ethynyl]-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid Openeye Name: 4-[2-(cyclohexen-1-yl)ethynyl]thiazol-2-amine; 4-methylbenzenesulfonic acid CAS Name: 4-[2-(1-cyclohexenyl)ethynyl]-2-thiazolamine; 4-methylbenzenesulfonic acid IUPAC Name: 4-[2-(cyclohexen-1-yl)ethynyl]-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid Traditional Name: [4-[2-(cyclohexen-1-yl)ethynyl]thiazol-2-yl]amine; tosylic acid Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CCC(=CC1)C#CC2=CSC(=N2)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CCC(=CC1)C#CC2=CSC(=N2)N

InChI

InChI=1S/C11H12N2S.C7H8O3S/c12-11-13-10(8-14-11)7-6-9-4-2-1-3-5-9;1-6-2-4-7(5-3-6)11(8,9)10/h4,8H,1-3,5H2,(H2,12,13);2-5H,1H3,(H,8,9,10)