N-butan-2-yl-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-butan-2-yl-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[[4-(ethylamino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-butan-2-yl-2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-(ethylamino)quinazolin-2-yl]thio]-N-sec-butyl-acetamide Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)NCC

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)NCC

InChI

InChI=1S/C16H22N4OS/c1-4-11(3)18-14(21)10-22-16-19-13-9-7-6-8-12(13)15(20-16)17-5-2/h6-9,11H,4-5,10H2,1-3H3,(H,18,21)(H,17,19,20)