[(E)-3-phenylprop-2-enyl] 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)ethanoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)ethanoate Openeye Name: [(E)-cinnamyl] 2-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)acetate CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylthio)acetic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)acetate Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetic acid [(E)-cinnamyl] ester Formula: C21H16N2O3S MolecularWeight: 376.42834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCOC(=O)CSC2=NC=NC3=C2OC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)/C=C/COC(=O)CSC2=NC=NC3=C2OC4=CC=CC=C43

InChI

InChI=1S/C21H16N2O3S/c24-18(25-12-6-9-15-7-2-1-3-8-15)13-27-21-20-19(22-14-23-21)16-10-4-5-11-17(16)26-20/h1-11,14H,12-13H2/b9-6+