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

Systemtic Name: N-[5-(diethylamino)pentan-2-yl]-4-[3-(2-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-[4-(diethylamino)-1-methyl-butyl]-4-[3-(2-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-[5-(diethylamino)pentan-2-yl]-4-[[3-(2-fluorophenyl)-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-[5-(diethylamino)pentan-2-yl]-4-[3-(2-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-[4-(diethylamino)-1-methyl-butyl]-4-[[3-(2-fluorophenyl)-4-keto-quinazolin-2-yl]thio]butyramide Formula: C27H35FN4O2S MolecularWeight: 498.655803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3F

Isomeric SMILES

CCN(CC)CCCC(C)NC(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3F

InChI

InChI=1S/C27H35FN4O2S/c1-4-31(5-2)18-10-12-20(3)29-25(33)17-11-19-35-27-30-23-15-8-6-13-21(23)26(34)32(27)24-16-9-7-14-22(24)28/h6-9,13-16,20H,4-5,10-12,17-19H2,1-3H3,(H,29,33)