azanylidene-methyl-phenyl-$l^{4}-sulfane; 2,4,6-trimethylbenzenesulfonic acid

Systemtic Name: azanylidene-methyl-phenyl-$l^{4}-sulfane; 2,4,6-trimethylbenzenesulfonic acid Openeye Name: imino-methyl-phenyl-$l^{4}-sulfane; 2,4,6-trimethylbenzenesulfonic acid CAS Name: imino-methyl-phenyl-$l^{4}-sulfane; 2,4,6-trimethylbenzenesulfonic acid IUPAC Name: imino-methyl-phenyl-$l^{4}-sulfane; 2,4,6-trimethylbenzenesulfonic acid Traditional Name: imino-methyl-phenyl-sulfurane; 2,4,6-trimethylbesylic acid Formula: C16H21NO3S2 MolecularWeight: 339.47284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)O)C.CS(=N)C1=CC=CC=C1

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)O)C.CS(=N)C1=CC=CC=C1

InChI

InChI=1S/C9H12O3S.C7H9NS/c1-6-4-7(2)9(8(3)5-6)13(10,11)12;1-9(8)7-5-3-2-4-6-7/h4-5H,1-3H3,(H,10,11,12);2-6,8H,1H3