[2-acetamido-9-(2,3-dihydro-1H-inden-2-yl)purin-6-yl] N,N-diphenylcarbamate

Systemtic Name: [2-acetamido-9-(2,3-dihydro-1H-inden-2-yl)purin-6-yl] N,N-diphenylcarbamate Openeye Name: (2-acetamido-9-indan-2-yl-purin-6-yl) N,N-diphenylcarbamate CAS Name: N,N-diphenylcarbamic acid [2-acetamido-9-(2,3-dihydro-1H-inden-2-yl)-6-purinyl] ester IUPAC Name: [2-acetamido-9-(2,3-dihydro-1H-inden-2-yl)purin-6-yl] N,N-diphenylcarbamate Traditional Name: N,N-diphenylcarbamic acid (2-acetamido-9-indan-2-yl-purin-6-yl) ester Formula: C29H24N6O3 MolecularWeight: 504.53926

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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=CN2C5CC6=CC=CC=C6C5

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)OC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)N=CN2C5CC6=CC=CC=C6C5

InChI

InChI=1S/C29H24N6O3/c1-19(36)31-28-32-26-25(30-18-34(26)24-16-20-10-8-9-11-21(20)17-24)27(33-28)38-29(37)35(22-12-4-2-5-13-22)23-14-6-3-7-15-23/h2-15,18,24H,16-17H2,1H3,(H,31,32,33,36)