2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-pentyl-ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-pentyl-ethanamide Openeye Name: 2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-N-pentyl-acetamide CAS Name: 2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]-N-pentylacetamide IUPAC Name: 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-pentylacetamide Traditional Name: N-amyl-2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CCCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-2-3-9-14-23-20(26)16-28-22-24-19-13-8-7-12-18(19)21(27)25(22)15-17-10-5-4-6-11-17/h4-8,10-13H,2-3,9,14-16H2,1H3,(H,23,26)