(2R)-2-(4-tert-butylpyridin-1-ium-1-yl)-3-oxidanylidene-N-prop-2-enyl-3-thiophen-2-yl-propanethioamide

Systemtic Name: (2R)-2-(4-tert-butylpyridin-1-ium-1-yl)-3-oxidanylidene-N-prop-2-enyl-3-thiophen-2-yl-propanethioamide Openeye Name: (2R)-N-allyl-2-(4-tert-butylpyridin-1-ium-1-yl)-3-oxo-3-(2-thienyl)propanethioamide CAS Name: (2R)-2-(4-tert-butyl-1-pyridin-1-iumyl)-3-oxo-N-prop-2-enyl-3-thiophen-2-ylpropanethioamide IUPAC Name: (2R)-2-(4-tert-butylpyridin-1-ium-1-yl)-3-oxo-N-prop-2-enyl-3-thiophen-2-ylpropanethioamide Traditional Name: (2R)-N-allyl-2-(4-tert-butylpyridin-1-ium-1-yl)-3-keto-3-(2-thienyl)thiopropionamide Formula: C19H23N2OS2+ MolecularWeight: 359.52872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=[N+](C=C1)C(C(=O)C2=CC=CS2)C(=S)NCC=C

Isomeric SMILES

CC(C)(C)C1=CC=[N+](C=C1)[C@H](C(=O)C2=CC=CS2)C(=S)NCC=C

InChI

InChI=1S/C19H22N2OS2/c1-5-10-20-18(23)16(17(22)15-7-6-13-24-15)21-11-8-14(9-12-21)19(2,3)4/h5-9,11-13,16H,1,10H2,2-4H3/p+1/t16-/m1/s1