(2R)-2-(4-oxidanylidene-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoate

Systemtic Name: (2R)-2-(4-oxidanylidene-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoate Openeye Name: (2R)-2-(3-allyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoate CAS Name: (2R)-2-[(4-oxo-5-phenyl-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]propanoate IUPAC Name: (2R)-2-(4-oxo-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoate Traditional Name: (2R)-2-[(3-allyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionate Formula: C18H15N2O3S2- MolecularWeight: 371.4533

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1CC=C

Isomeric SMILES

C[C@H](C(=O)[O-])SC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1CC=C

InChI

InChI=1S/C18H16N2O3S2/c1-3-9-20-16(21)14-13(12-7-5-4-6-8-12)10-24-15(14)19-18(20)25-11(2)17(22)23/h3-8,10-11H,1,9H2,2H3,(H,22,23)/p-1/t11-/m1/s1