(4S)-1-(6-fluoranyl-4-methyl-quinazolin-2-yl)-N-[(2-fluorophenyl)methyl]azepan-4-amine

Systemtic Name: (4S)-1-(6-fluoranyl-4-methyl-quinazolin-2-yl)-N-[(2-fluorophenyl)methyl]azepan-4-amine Openeye Name: (4S)-1-(6-fluoro-4-methyl-quinazolin-2-yl)-N-[(2-fluorophenyl)methyl]azepan-4-amine CAS Name: (4S)-1-(6-fluoro-4-methyl-2-quinazolinyl)-N-[(2-fluorophenyl)methyl]-4-azepanamine IUPAC Name: (4S)-1-(6-fluoro-4-methylquinazolin-2-yl)-N-[(2-fluorophenyl)methyl]azepan-4-amine Traditional Name: (2-fluorobenzyl)-[(4S)-1-(6-fluoro-4-methyl-quinazolin-2-yl)azepan-4-yl]amine Formula: C22H24F2N4 MolecularWeight: 382.449566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)F)N3CCCC(CC3)NCC4=CC=CC=C4F

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)F)N3CCC[C@@H](CC3)NCC4=CC=CC=C4F

InChI

InChI=1S/C22H24F2N4/c1-15-19-13-17(23)8-9-21(19)27-22(26-15)28-11-4-6-18(10-12-28)25-14-16-5-2-3-7-20(16)24/h2-3,5,7-9,13,18,25H,4,6,10-12,14H2,1H3/t18-/m0/s1