N,9-bis(prop-2-enyl)-2-[4-(2,2,2-triphenylethylamino)piperidin-1-yl]purin-6-amine

Systemtic Name: N,9-bis(prop-2-enyl)-2-[4-(2,2,2-triphenylethylamino)piperidin-1-yl]purin-6-amine Openeye Name: N,9-diallyl-2-[4-(2,2,2-triphenylethylamino)-1-piperidyl]purin-6-amine CAS Name: N,9-bis(prop-2-enyl)-2-[4-(2,2,2-triphenylethylamino)-1-piperidinyl]-6-purinamine IUPAC Name: N,9-bis(prop-2-enyl)-2-[4-(2,2,2-triphenylethylamino)piperidin-1-yl]purin-6-amine Traditional Name: allyl-[9-allyl-2-[4-(2,2,2-triphenylethylamino)piperidino]purin-6-yl]amine Formula: C36H39N7 MolecularWeight: 569.74176

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=NC2=C1N=CN2CC=C)N3CCC(CC3)NCC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C=CCNC1=NC(=NC2=C1N=CN2CC=C)N3CCC(CC3)NCC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C36H39N7/c1-3-22-37-33-32-34(43(23-4-2)27-39-32)41-35(40-33)42-24-20-31(21-25-42)38-26-36(28-14-8-5-9-15-28,29-16-10-6-11-17-29)30-18-12-7-13-19-30/h3-19,27,31,38H,1-2,20-26H2,(H,37,40,41)