sodium 2-[4-[chloranyl(phenylsulfonyl)methyl]-3-ethyl-4H-pyridin-1-yl]propanedinitrile

Systemtic Name: sodium 2-[4-[chloranyl(phenylsulfonyl)methyl]-3-ethyl-4H-pyridin-1-yl]propanedinitrile Openeye Name: sodium 2-[4-[benzenesulfonyl(chloro)methyl]-3-ethyl-4H-pyridin-1-yl]propanedinitrile CAS Name: sodium 2-[4-[benzenesulfonyl(chloro)methyl]-3-ethyl-4H-pyridin-1-yl]propanedinitrile IUPAC Name: sodium 2-[4-[benzenesulfonyl(chloro)methyl]-3-ethyl-4H-pyridin-1-yl]propanedinitrile Traditional Name: sodium 2-[4-[besyl(chloro)methyl]-3-ethyl-4H-pyridin-1-yl]malononitrile Formula: C17H15ClN3NaO2S MolecularWeight: 383.82767

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C=CC1C(S(=O)(=O)C2=CC=CC=C2)Cl)[C-](C#N)C#N.[Na+]

Isomeric SMILES

CCC1=CN(C=CC1C(S(=O)(=O)C2=CC=CC=C2)Cl)[C-](C#N)C#N.[Na+]

InChI

InChI=1S/C17H15ClN3O2S.Na/c1-2-13-12-21(14(10-19)11-20)9-8-16(13)17(18)24(22,23)15-6-4-3-5-7-15;/h3-9,12,16-17H,2H2,1H3;/q-1;+1