N4-(3-bromophenyl)-7-(3-imidazol-1-ylpropoxy)quinazoline-4,6-diamine

Systemtic Name: N4-(3-bromophenyl)-7-(3-imidazol-1-ylpropoxy)quinazoline-4,6-diamine Openeye Name: N4-(3-bromophenyl)-7-(3-imidazol-1-ylpropoxy)quinazoline-4,6-diamine CAS Name: N4-(3-bromophenyl)-7-[3-(1-imidazolyl)propoxy]quinazoline-4,6-diamine IUPAC Name: 4-N-(3-bromophenyl)-7-(3-imidazol-1-ylpropoxy)quinazoline-4,6-diamine Traditional Name: [6-amino-7-(3-imidazol-1-ylpropoxy)quinazolin-4-yl]-(3-bromophenyl)amine Formula: C20H19BrN6O MolecularWeight: 439.30846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=NC=NC3=CC(=C(C=C32)N)OCCCN4C=CN=C4

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=NC=NC3=CC(=C(C=C32)N)OCCCN4C=CN=C4

InChI

InChI=1S/C20H19BrN6O/c21-14-3-1-4-15(9-14)26-20-16-10-17(22)19(11-18(16)24-12-25-20)28-8-2-6-27-7-5-23-13-27/h1,3-5,7,9-13H,2,6,8,22H2,(H,24,25,26)