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

Systemtic Name: N-(4-ethoxyphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[2-(phenoxymethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: 2-[[2-(phenoxymethyl)quinazolin-4-yl]thio]-N-p-phenetyl-acetamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)COC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)COC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O3S/c1-2-30-20-14-12-18(13-15-20)26-24(29)17-32-25-21-10-6-7-11-22(21)27-23(28-25)16-31-19-8-4-3-5-9-19/h3-15H,2,16-17H2,1H3,(H,26,29)