2-ethylsulfanyl-4,6-bis(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-ethylsulfanyl-4,6-bis(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-ethylsulfanyl-4,6-bis(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-(ethylthio)-4,6-bis(4-methoxyphenyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-ethylsulfanyl-4,6-bis(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-(ethylthio)-4,6-bis(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile Formula: C22H21N2O2S+ MolecularWeight: 377.47934

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=CC(=[NH+]1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CCSC1=C(C(=CC(=[NH+]1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C22H20N2O2S/c1-4-27-22-20(14-23)19(15-5-9-17(25-2)10-6-15)13-21(24-22)16-7-11-18(26-3)12-8-16/h5-13H,4H2,1-3H3/p+1