1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine; sulfuric acid

Systemtic Name: 1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine; sulfuric acid Openeye Name: 1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine; sulfuric acid CAS Name: 1-[2-[(2,4-dimethylphenyl)thio]phenyl]piperazine; sulfuric acid IUPAC Name: 1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine; sulfuric acid Traditional Name: 1-[2-[(2,4-dimethylphenyl)thio]phenyl]piperazine; sulfuric acid Formula: C18H24N2O4S2 MolecularWeight: 396.52416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=CC=CC=C2N3CCNCC3)C.OS(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=CC=CC=C2N3CCNCC3)C.OS(=O)(=O)O

InChI

InChI=1S/C18H22N2S.H2O4S/c1-14-7-8-17(15(2)13-14)21-18-6-4-3-5-16(18)20-11-9-19-10-12-20;1-5(2,3)4/h3-8,13,19H,9-12H2,1-2H3;(H2,1,2,3,4)