2-(2-azanylidene-1,3-thiazolidin-3-yl)-1-phenyl-ethanol; 4-methylbenzenesulfonic acid

Systemtic Name: 2-(2-azanylidene-1,3-thiazolidin-3-yl)-1-phenyl-ethanol; 4-methylbenzenesulfonic acid Openeye Name: 2-(2-iminothiazolidin-3-yl)-1-phenyl-ethanol; 4-methylbenzenesulfonic acid CAS Name: 2-(2-imino-3-thiazolidinyl)-1-phenylethanol; 4-methylbenzenesulfonic acid IUPAC Name: 2-(2-imino-1,3-thiazolidin-3-yl)-1-phenylethanol; 4-methylbenzenesulfonic acid Traditional Name: 2-(2-iminothiazolidin-3-yl)-1-phenyl-ethanol; tosylic acid Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CSC(=N)N1CC(C2=CC=CC=C2)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CSC(=N)N1CC(C2=CC=CC=C2)O

InChI

InChI=1S/C11H14N2OS.C7H8O3S/c12-11-13(6-7-15-11)8-10(14)9-4-2-1-3-5-9;1-6-2-4-7(5-3-6)11(8,9)10/h1-5,10,12,14H,6-8H2;2-5H,1H3,(H,8,9,10)