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2-(cyclopropylamino)-9-(2-methoxyphenyl)-7-(phenylmethyl)purin-8-one

2-(cyclopropylamino)-9-(2-methoxyphenyl)-7-(phenylmethyl)purin-8-one

Systemtic Name:2-(cyclopropylamino)-9-(2-methoxyphenyl)-7-(phenylmethyl)purin-8-one
Openeye Name:7-benzyl-2-(cyclopropylamino)-9-(2-methoxyphenyl)purin-8-one
CAS Name:2-(cyclopropylamino)-9-(2-methoxyphenyl)-7-(phenylmethyl)-8-purinone
IUPAC Name:7-benzyl-2-(cyclopropylamino)-9-(2-methoxyphenyl)purin-8-one
Traditional Name:7-benzyl-2-(cyclopropylamino)-9-(2-methoxyphenyl)purin-8-one
Formula: C22H21N5O2
MolecularWeight: 387.43444
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=NC(=NC=C3N(C2=O)CC4=CC=CC=C4)NC5CC5


Isomeric SMILES

COC1=CC=CC=C1N2C3=NC(=NC=C3N(C2=O)CC4=CC=CC=C4)NC5CC5


InChI

InChI=1S/C22H21N5O2/c1-29-19-10-6-5-9-17(19)27-20-18(13-23-21(25-20)24-16-11-12-16)26(22(27)28)14-15-7-3-2-4-8-15/h2-10,13,16H,11-12,14H2,1H3,(H,23,24,25)


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