[2-acetamido-9-(1,2,3,4-tetrahydronaphthalen-1-yl)purin-6-yl] N,N-diphenylcarbamate

Systemtic Name: [2-acetamido-9-(1,2,3,4-tetrahydronaphthalen-1-yl)purin-6-yl] N,N-diphenylcarbamate Openeye Name: (2-acetamido-9-tetralin-1-yl-purin-6-yl) N,N-diphenylcarbamate CAS Name: N,N-diphenylcarbamic acid [2-acetamido-9-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-purinyl] ester IUPAC Name: [2-acetamido-9-(1,2,3,4-tetrahydronaphthalen-1-yl)purin-6-yl] N,N-diphenylcarbamate Traditional Name: N,N-diphenylcarbamic acid (2-acetamido-9-tetralin-1-yl-purin-6-yl) ester Formula: C30H26N6O3 MolecularWeight: 518.56584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)OC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)N=CN2C5CCCC6=CC=CC=C56

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)OC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)N=CN2C5CCCC6=CC=CC=C56

InChI

InChI=1S/C30H26N6O3/c1-20(37)32-29-33-27-26(31-19-35(27)25-18-10-12-21-11-8-9-17-24(21)25)28(34-29)39-30(38)36(22-13-4-2-5-14-22)23-15-6-3-7-16-23/h2-9,11,13-17,19,25H,10,12,18H2,1H3,(H,32,33,34,37)