2-[2-[(E)-2-phenylethenyl]quinazolin-4-yl]sulfanylethanoate

Systemtic Name: 2-[2-[(E)-2-phenylethenyl]quinazolin-4-yl]sulfanylethanoate Openeye Name: 2-[2-[(E)-styryl]quinazolin-4-yl]sulfanylacetate CAS Name: 2-[[2-[(E)-2-phenylethenyl]-4-quinazolinyl]thio]acetate IUPAC Name: 2-[2-[(E)-2-phenylethenyl]quinazolin-4-yl]sulfanylacetate Traditional Name: 2-[[2-[(E)-styryl]quinazolin-4-yl]thio]acetate Formula: C18H13N2O2S- MolecularWeight: 321.37302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=NC3=CC=CC=C3C(=N2)SCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=NC3=CC=CC=C3C(=N2)SCC(=O)[O-]

InChI

InChI=1S/C18H14N2O2S/c21-17(22)12-23-18-14-8-4-5-9-15(14)19-16(20-18)11-10-13-6-2-1-3-7-13/h1-11H,12H2,(H,21,22)/p-1/b11-10+