6-chloranyl-5-(8-naphthalen-2-yl-8-azabicyclo[3.2.1]octan-3-yl)pyrimidine-2,4-diamine

Systemtic Name: 6-chloranyl-5-(8-naphthalen-2-yl-8-azabicyclo[3.2.1]octan-3-yl)pyrimidine-2,4-diamine Openeye Name: 6-chloro-5-[8-(2-naphthyl)-8-azabicyclo[3.2.1]octan-3-yl]pyrimidine-2,4-diamine CAS Name: 6-chloro-5-[8-(2-naphthalenyl)-8-azabicyclo[3.2.1]octan-3-yl]pyrimidine-2,4-diamine IUPAC Name: 6-chloro-5-(8-naphthalen-2-yl-8-azabicyclo[3.2.1]octan-3-yl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-chloro-5-[8-(2-naphthyl)-8-azabicyclo[3.2.1]octan-3-yl]pyrimidin-4-yl]amine Formula: C21H22ClN5 MolecularWeight: 379.88588

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2C3=CC4=CC=CC=C4C=C3)C5=C(N=C(N=C5Cl)N)N

Isomeric SMILES

C1CC2CC(CC1N2C3=CC4=CC=CC=C4C=C3)C5=C(N=C(N=C5Cl)N)N

InChI

InChI=1S/C21H22ClN5/c22-19-18(20(23)26-21(24)25-19)14-10-16-7-8-17(11-14)27(16)15-6-5-12-3-1-2-4-13(12)9-15/h1-6,9,14,16-17H,7-8,10-11H2,(H4,23,24,25,26)