(2,5-dimethylphenyl)-(4-methylphenyl)-phenyl-sulfanium; (2S)-propane-1,2-diol

Systemtic Name: (2,5-dimethylphenyl)-(4-methylphenyl)-phenyl-sulfanium; (2S)-propane-1,2-diol Openeye Name: (2,5-dimethylphenyl)-phenyl-(p-tolyl)sulfonium; (2S)-propane-1,2-diol CAS Name: (2,5-dimethylphenyl)-(4-methylphenyl)-phenylsulfonium; (2S)-propane-1,2-diol IUPAC Name: (2,5-dimethylphenyl)-(4-methylphenyl)-phenylsulfanium; (2S)-propane-1,2-diol Traditional Name: (2,5-dimethylphenyl)-phenyl-(p-tolyl)sulfonium; (2S)-propane-1,2-diol Formula: C24H29O2S+ MolecularWeight: 381.55086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=C(C=CC(=C3)C)C.CC(CO)O

Isomeric SMILES

CC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=C(C=CC(=C3)C)C.C[C@@H](CO)O

InChI

InChI=1S/C21H21S.C3H8O2/c1-16-10-13-20(14-11-16)22(19-7-5-4-6-8-19)21-15-17(2)9-12-18(21)3;1-3(5)2-4/h4-15H,1-3H3;3-5H,2H2,1H3/q+1;/t;3-/m.0/s1