N-[3-(2,2-diphenylethyl)-2-methylsulfonyl-oxan-2-yl]-7H-purin-6-amine

Systemtic Name: N-[3-(2,2-diphenylethyl)-2-methylsulfonyl-oxan-2-yl]-7H-purin-6-amine Openeye Name: N-[3-(2,2-diphenylethyl)-2-methylsulfonyl-tetrahydropyran-2-yl]-7H-purin-6-amine CAS Name: N-[3-(2,2-diphenylethyl)-2-methylsulfonyl-2-oxanyl]-7H-purin-6-amine IUPAC Name: N-[3-(2,2-diphenylethyl)-2-methylsulfonyloxan-2-yl]-7H-purin-6-amine Traditional Name: [3-(2,2-diphenylethyl)-2-mesyl-tetrahydropyran-2-yl]-(7H-purin-6-yl)amine Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1(C(CCCO1)CC(C2=CC=CC=C2)C3=CC=CC=C3)NC4=NC=NC5=C4NC=N5

Isomeric SMILES

CS(=O)(=O)C1(C(CCCO1)CC(C2=CC=CC=C2)C3=CC=CC=C3)NC4=NC=NC5=C4NC=N5

InChI

InChI=1S/C25H27N5O3S/c1-34(31,32)25(30-24-22-23(27-16-26-22)28-17-29-24)20(13-8-14-33-25)15-21(18-9-4-2-5-10-18)19-11-6-3-7-12-19/h2-7,9-12,16-17,20-21H,8,13-15H2,1H3,(H2,26,27,28,29,30)