[4-(1-ethoxyethoxy)phenyl]-dipyridin-3-yl-sulfanium; 4-methylbenzenesulfonate

Systemtic Name: [4-(1-ethoxyethoxy)phenyl]-dipyridin-3-yl-sulfanium; 4-methylbenzenesulfonate Openeye Name: [4-(1-ethoxyethoxy)phenyl]-bis(3-pyridyl)sulfonium; 4-methylbenzenesulfonate CAS Name: [4-(1-ethoxyethoxy)phenyl]-bis(3-pyridinyl)sulfonium; 4-methylbenzenesulfonate IUPAC Name: [4-(1-ethoxyethoxy)phenyl]-dipyridin-3-ylsulfanium; 4-methylbenzenesulfonate Traditional Name: [4-(1-ethoxyethoxy)phenyl]-bis(3-pyridyl)sulfonium tosylate Formula: C27H28N2O5S2 MolecularWeight: 524.65162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)OC1=CC=C(C=C1)[S+](C2=CN=CC=C2)C3=CN=CC=C3.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCOC(C)OC1=CC=C(C=C1)[S+](C2=CN=CC=C2)C3=CN=CC=C3.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C20H21N2O2S.C7H8O3S/c1-3-23-16(2)24-17-8-10-18(11-9-17)25(19-6-4-12-21-14-19)20-7-5-13-22-15-20;1-6-2-4-7(5-3-6)11(8,9)10/h4-16H,3H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1