2-[4-[(6-fluoranyl-1H-benzimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-4,6,7-trimethyl-quinazoline

Systemtic Name: 2-[4-[(6-fluoranyl-1H-benzimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-4,6,7-trimethyl-quinazoline Openeye Name: 2-[4-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-4,6,7-trimethyl-quinazoline CAS Name: 2-[4-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-4,6,7-trimethylquinazoline IUPAC Name: 2-[4-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-4,6,7-trimethylquinazoline Traditional Name: 2-[4-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-4,6,7-trimethyl-quinazoline Formula: C24H27FN6 MolecularWeight: 418.509783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCCN(CC3)CC4=NC5=C(N4)C=C(C=C5)F)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCCN(CC3)CC4=NC5=C(N4)C=C(C=C5)F)C)C

InChI

InChI=1S/C24H27FN6/c1-15-11-19-17(3)26-24(29-21(19)12-16(15)2)31-8-4-7-30(9-10-31)14-23-27-20-6-5-18(25)13-22(20)28-23/h5-6,11-13H,4,7-10,14H2,1-3H3,(H,27,28)