(E)-3-(1-tert-butyl-2-sulfanylidene-pyridin-3-yl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(1-tert-butyl-2-sulfanylidene-pyridin-3-yl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(1-tert-butyl-2-thioxo-3-pyridyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(1-tert-butyl-2-sulfanylidene-3-pyridinyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(1-tert-butyl-2-sulfanylidenepyridin-3-yl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(1-tert-butyl-2-thioxo-3-pyridyl)acrylonitrile Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=CC=C(C1=S)C=C(C#N)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)N1C=CC=C(C1=S)/C=C(\C#N)/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H18N2OS/c1-19(2,3)21-11-7-10-15(18(21)23)12-16(13-20)17(22)14-8-5-4-6-9-14/h4-12H,1-3H3/b16-12+