(2R)-2-[2-[(E)-2-phenylethenyl]quinazolin-4-yl]sulfanylpropanoate

Systemtic Name: (2R)-2-[2-[(E)-2-phenylethenyl]quinazolin-4-yl]sulfanylpropanoate Openeye Name: (2R)-2-[2-[(E)-styryl]quinazolin-4-yl]sulfanylpropanoate CAS Name: (2R)-2-[[2-[(E)-2-phenylethenyl]-4-quinazolinyl]thio]propanoate IUPAC Name: (2R)-2-[2-[(E)-2-phenylethenyl]quinazolin-4-yl]sulfanylpropanoate Traditional Name: (2R)-2-[[2-[(E)-styryl]quinazolin-4-yl]thio]propionate Formula: C19H15N2O2S- MolecularWeight: 335.3996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NC(=NC2=CC=CC=C21)C=CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)[O-])SC1=NC(=NC2=CC=CC=C21)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H16N2O2S/c1-13(19(22)23)24-18-15-9-5-6-10-16(15)20-17(21-18)12-11-14-7-3-2-4-8-14/h2-13H,1H3,(H,22,23)/p-1/b12-11+/t13-/m1/s1