N6-tert-butyl-N2-[4-[6-(2-morpholin-4-ylethoxy)naphthalen-2-yl]phenyl]-7H-purine-2,6-diamine

Systemtic Name: N6-tert-butyl-N2-[4-[6-(2-morpholin-4-ylethoxy)naphthalen-2-yl]phenyl]-7H-purine-2,6-diamine Openeye Name: N6-tert-butyl-N2-[4-[6-(2-morpholinoethoxy)-2-naphthyl]phenyl]-7H-purine-2,6-diamine CAS Name: N6-tert-butyl-N2-[4-[6-[2-(4-morpholinyl)ethoxy]-2-naphthalenyl]phenyl]-7H-purine-2,6-diamine IUPAC Name: 6-N-tert-butyl-2-N-[4-[6-(2-morpholin-4-ylethoxy)naphthalen-2-yl]phenyl]-7H-purine-2,6-diamine Traditional Name: tert-butyl-[2-[4-[6-(2-morpholinoethoxy)-2-naphthyl]anilino]-7H-purin-6-yl]amine Formula: C31H35N7O2 MolecularWeight: 537.6553

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC2=C1NC=N2)NC3=CC=C(C=C3)C4=CC5=C(C=C4)C=C(C=C5)OCCN6CCOCC6

Isomeric SMILES

CC(C)(C)NC1=NC(=NC2=C1NC=N2)NC3=CC=C(C=C3)C4=CC5=C(C=C4)C=C(C=C5)OCCN6CCOCC6

InChI

InChI=1S/C31H35N7O2/c1-31(2,3)37-29-27-28(33-20-32-27)35-30(36-29)34-25-9-6-21(7-10-25)22-4-5-24-19-26(11-8-23(24)18-22)40-17-14-38-12-15-39-16-13-38/h4-11,18-20H,12-17H2,1-3H3,(H3,32,33,34,35,36,37)