S-tert-butyl (2Z)-2-(furan-2-ylmethylidene)-3-oxidanylidene-butanethioate

Systemtic Name: S-tert-butyl (2Z)-2-(furan-2-ylmethylidene)-3-oxidanylidene-butanethioate Openeye Name: S-tert-butyl (2Z)-2-(2-furylmethylene)-3-oxo-butanethioate CAS Name: (2Z)-2-(2-furanylmethylidene)-3-oxobutanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (2Z)-2-(furan-2-ylmethylidene)-3-oxobutanethioate Traditional Name: (Z)-2-acetyl-3-(2-furyl)prop-2-enethioic acid S-tert-butyl ester Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CO1)C(=O)SC(C)(C)C

Isomeric SMILES

CC(=O)/C(=C/C1=CC=CO1)/C(=O)SC(C)(C)C

InChI

InChI=1S/C13H16O3S/c1-9(14)11(8-10-6-5-7-16-10)12(15)17-13(2,3)4/h5-8H,1-4H3/b11-8-