ethyl (E)-3-(1-tert-butyl-2-sulfanylidene-pyridin-3-yl)-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-(1-tert-butyl-2-sulfanylidene-pyridin-3-yl)-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-(1-tert-butyl-2-thioxo-3-pyridyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(1-tert-butyl-2-sulfanylidene-3-pyridinyl)-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-tert-butyl-2-sulfanylidenepyridin-3-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(1-tert-butyl-2-thioxo-3-pyridyl)-2-cyano-acrylic acid ethyl ester Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=CN(C1=S)C(C)(C)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=CN(C1=S)C(C)(C)C)/C#N

InChI

InChI=1S/C15H18N2O2S/c1-5-19-14(18)12(10-16)9-11-7-6-8-17(13(11)20)15(2,3)4/h6-9H,5H2,1-4H3/b12-9+