ethyl (2S)-2-phenyl-2-quinazolin-4-ylsulfanyl-ethanoate

Systemtic Name: ethyl (2S)-2-phenyl-2-quinazolin-4-ylsulfanyl-ethanoate Openeye Name: ethyl (2S)-2-phenyl-2-quinazolin-4-ylsulfanyl-acetate CAS Name: (2S)-2-phenyl-2-(4-quinazolinylthio)acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-phenyl-2-quinazolin-4-ylsulfanylacetate Traditional Name: (2S)-2-phenyl-2-(quinazolin-4-ylthio)acetic acid ethyl ester Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)SC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)[C@H](C1=CC=CC=C1)SC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C18H16N2O2S/c1-2-22-18(21)16(13-8-4-3-5-9-13)23-17-14-10-6-7-11-15(14)19-12-20-17/h3-12,16H,2H2,1H3/t16-/m0/s1