N-(2-methylpropyl)-2-[3-(3-morpholin-4-ylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-methylpropyl)-2-[3-(3-morpholin-4-ylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-isobutyl-2-[3-(3-morpholinopropyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2-methylpropyl)-2-[[3-[3-(4-morpholinyl)propyl]-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(2-methylpropyl)-2-[3-(3-morpholin-4-ylpropyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-isobutyl-2-[[4-keto-3-(3-morpholinopropyl)quinazolin-2-yl]thio]acetamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCN3CCOCC3

Isomeric SMILES

CC(C)CNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCN3CCOCC3

InChI

InChI=1S/C21H30N4O3S/c1-16(2)14-22-19(26)15-29-21-23-18-7-4-3-6-17(18)20(27)25(21)9-5-8-24-10-12-28-13-11-24/h3-4,6-7,16H,5,8-15H2,1-2H3,(H,22,26)