N5-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-5-cyclohexyl-N4,N4-dimethyl-7,8-dihydro-6H-quinazoline-2,4,5-triamine

Systemtic Name: N5-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-5-cyclohexyl-N4,N4-dimethyl-7,8-dihydro-6H-quinazoline-2,4,5-triamine Openeye Name: N5-[(3-bromo-4-fluoro-phenyl)methyl]-5-cyclohexyl-N4,N4-dimethyl-7,8-dihydro-6H-quinazoline-2,4,5-triamine CAS Name: N5-[(3-bromo-4-fluorophenyl)methyl]-5-cyclohexyl-N4,N4-dimethyl-7,8-dihydro-6H-quinazoline-2,4,5-triamine IUPAC Name: 5-N-[(3-bromo-4-fluorophenyl)methyl]-5-cyclohexyl-4-N,4-N-dimethyl-7,8-dihydro-6H-quinazoline-2,4,5-triamine Traditional Name: [2-amino-5-[(3-bromo-4-fluoro-benzyl)amino]-5-cyclohexyl-7,8-dihydro-6H-quinazolin-4-yl]-dimethyl-amine Formula: C23H31BrFN5 MolecularWeight: 476.428143

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=C1C(CCC2)(C3CCCCC3)NCC4=CC(=C(C=C4)F)Br)N

Isomeric SMILES

CN(C)C1=NC(=NC2=C1C(CCC2)(C3CCCCC3)NCC4=CC(=C(C=C4)F)Br)N

InChI

InChI=1S/C23H31BrFN5/c1-30(2)21-20-19(28-22(26)29-21)9-6-12-23(20,16-7-4-3-5-8-16)27-14-15-10-11-18(25)17(24)13-15/h10-11,13,16,27H,3-9,12,14H2,1-2H3,(H2,26,28,29)