2-(4-methylphenyl)sulfonyl-3-(2-sulfanylideneimidazolidin-1-yl)prop-2-enenitrile

Systemtic Name: 2-(4-methylphenyl)sulfonyl-3-(2-sulfanylideneimidazolidin-1-yl)prop-2-enenitrile Openeye Name: 2-(p-tolylsulfonyl)-3-(2-thioxoimidazolidin-1-yl)prop-2-enenitrile CAS Name: 2-(4-methylphenyl)sulfonyl-3-(2-sulfanylidene-1-imidazolidinyl)-2-propenenitrile IUPAC Name: 2-(4-methylphenyl)sulfonyl-3-(2-sulfanylideneimidazolidin-1-yl)prop-2-enenitrile Traditional Name: 3-(2-thioxoimidazolidin-1-yl)-2-tosyl-acrylonitrile Formula: C13H13N3O2S2 MolecularWeight: 307.39122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CN2CCNC2=S)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CN2CCNC2=S)C#N

InChI

InChI=1S/C13H13N3O2S2/c1-10-2-4-11(5-3-10)20(17,18)12(8-14)9-16-7-6-15-13(16)19/h2-5,9H,6-7H2,1H3,(H,15,19)