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

Systemtic Name: 2-[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-pentyl-ethanamide Openeye Name: 2-[3-(4-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-pentyl-acetamide CAS Name: 2-[[3-(4-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]-N-pentylacetamide IUPAC Name: 2-[3-(4-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-pentylacetamide Traditional Name: N-amyl-2-[[4-keto-3-(4-methyl-2-pyridyl)quinazolin-2-yl]thio]acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=NC=CC(=C3)C

Isomeric SMILES

CCCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=NC=CC(=C3)C

InChI

InChI=1S/C21H24N4O2S/c1-3-4-7-11-23-19(26)14-28-21-24-17-9-6-5-8-16(17)20(27)25(21)18-13-15(2)10-12-22-18/h5-6,8-10,12-13H,3-4,7,11,14H2,1-2H3,(H,23,26)