[4-(6-fluoranylquinazolin-2-yl)-7-methyl-1,4-diazepan-1-yl]-[2-(1,2,3-triazol-2-yl)phenyl]methanone

Systemtic Name: [4-(6-fluoranylquinazolin-2-yl)-7-methyl-1,4-diazepan-1-yl]-[2-(1,2,3-triazol-2-yl)phenyl]methanone Openeye Name: [4-(6-fluoroquinazolin-2-yl)-7-methyl-1,4-diazepan-1-yl]-[2-(triazol-2-yl)phenyl]methanone CAS Name: [4-(6-fluoro-2-quinazolinyl)-7-methyl-1,4-diazepan-1-yl]-[2-(2-triazolyl)phenyl]methanone IUPAC Name: [4-(6-fluoroquinazolin-2-yl)-7-methyl-1,4-diazepan-1-yl]-[2-(triazol-2-yl)phenyl]methanone Traditional Name: [4-(6-fluoroquinazolin-2-yl)-7-methyl-1,4-diazepan-1-yl]-[2-(triazol-2-yl)phenyl]methanone Formula: C23H22FN7O MolecularWeight: 431.465483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CCN1C(=O)C2=CC=CC=C2N3N=CC=N3)C4=NC=C5C=C(C=CC5=N4)F

Isomeric SMILES

CC1CCN(CCN1C(=O)C2=CC=CC=C2N3N=CC=N3)C4=NC=C5C=C(C=CC5=N4)F

InChI

InChI=1S/C23H22FN7O/c1-16-8-11-29(23-25-15-17-14-18(24)6-7-20(17)28-23)12-13-30(16)22(32)19-4-2-3-5-21(19)31-26-9-10-27-31/h2-7,9-10,14-16H,8,11-13H2,1H3