N6-(4-azanylcyclohexyl)-N4-(3-bromophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine

Systemtic Name: N6-(4-azanylcyclohexyl)-N4-(3-bromophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine Openeye Name: N6-(4-aminocyclohexyl)-N4-(3-bromophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine CAS Name: N6-(4-aminocyclohexyl)-N4-(3-bromophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine IUPAC Name: 6-N-(4-aminocyclohexyl)-4-N-(3-bromophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine Traditional Name: (4-aminocyclohexyl)-[4-(3-bromoanilino)pyrimido[5,4-d]pyrimidin-6-yl]amine Formula: C18H20BrN7 MolecularWeight: 414.3023

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CC(CCC1N)NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C18H20BrN7/c19-11-2-1-3-14(8-11)24-17-16-15(22-10-23-17)9-21-18(26-16)25-13-6-4-12(20)5-7-13/h1-3,8-10,12-13H,4-7,20H2,(H,21,25,26)(H,22,23,24)