N-[6-(4-fluorophenyl)-4-(3-methylbutylamino)quinazolin-2-yl]ethanamide

Systemtic Name: N-[6-(4-fluorophenyl)-4-(3-methylbutylamino)quinazolin-2-yl]ethanamide Openeye Name: N-[6-(4-fluorophenyl)-4-(isopentylamino)quinazolin-2-yl]acetamide CAS Name: N-[6-(4-fluorophenyl)-4-(3-methylbutylamino)-2-quinazolinyl]acetamide IUPAC Name: N-[6-(4-fluorophenyl)-4-(3-methylbutylamino)quinazolin-2-yl]acetamide Traditional Name: N-[6-(4-fluorophenyl)-4-(isoamylamino)quinazolin-2-yl]acetamide Formula: C21H23FN4O MolecularWeight: 366.431923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=NC2=C1C=C(C=C2)C3=CC=C(C=C3)F)NC(=O)C

Isomeric SMILES

CC(C)CCNC1=NC(=NC2=C1C=C(C=C2)C3=CC=C(C=C3)F)NC(=O)C

InChI

InChI=1S/C21H23FN4O/c1-13(2)10-11-23-20-18-12-16(15-4-7-17(22)8-5-15)6-9-19(18)25-21(26-20)24-14(3)27/h4-9,12-13H,10-11H2,1-3H3,(H2,23,24,25,26,27)