N-[5-(diethylamino)pentan-2-yl]-2-[3-(3-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[5-(diethylamino)pentan-2-yl]-2-[3-(3-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[4-(diethylamino)-1-methyl-butyl]-2-[3-(3-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[5-(diethylamino)pentan-2-yl]-2-[[3-(3-fluorophenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[5-(diethylamino)pentan-2-yl]-2-[3-(3-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[4-(diethylamino)-1-methyl-butyl]-2-[[3-(3-fluorophenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C25H31FN4O2S MolecularWeight: 470.602643

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC=C3)F

Isomeric SMILES

CCN(CC)CCCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC=C3)F

InChI

InChI=1S/C25H31FN4O2S/c1-4-29(5-2)15-9-10-18(3)27-23(31)17-33-25-28-22-14-7-6-13-21(22)24(32)30(25)20-12-8-11-19(26)16-20/h6-8,11-14,16,18H,4-5,9-10,15,17H2,1-3H3,(H,27,31)