N-(2-ethylphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2-ethylphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-ethylphenyl)-2-[[2-(phenoxymethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-(phenoxymethyl)quinazolin-4-yl]thio]acetamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=NC(=NC3=CC=CC=C32)COC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=NC(=NC3=CC=CC=C32)COC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O2S/c1-2-18-10-6-8-14-21(18)27-24(29)17-31-25-20-13-7-9-15-22(20)26-23(28-25)16-30-19-11-4-3-5-12-19/h3-15H,2,16-17H2,1H3,(H,27,29)