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7-(cyclopropylmethyl)-3-phenyl-1-(phenylmethyl)purine-2,6-dione

7-(cyclopropylmethyl)-3-phenyl-1-(phenylmethyl)purine-2,6-dione

Systemtic Name:7-(cyclopropylmethyl)-3-phenyl-1-(phenylmethyl)purine-2,6-dione
Openeye Name:1-benzyl-7-(cyclopropylmethyl)-3-phenyl-purine-2,6-dione
CAS Name:7-(cyclopropylmethyl)-3-phenyl-1-(phenylmethyl)purine-2,6-dione
IUPAC Name:1-benzyl-7-(cyclopropylmethyl)-3-phenylpurine-2,6-dione
Traditional Name:1-benzyl-7-(cyclopropylmethyl)-3-phenyl-xanthine
Formula: C22H20N4O2
MolecularWeight: 372.4198
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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C=NC3=C2C(=O)N(C(=O)N3C4=CC=CC=C4)CC5=CC=CC=C5


Isomeric SMILES

C1CC1CN2C=NC3=C2C(=O)N(C(=O)N3C4=CC=CC=C4)CC5=CC=CC=C5


InChI

InChI=1S/C22H20N4O2/c27-21-19-20(23-15-24(19)13-17-11-12-17)26(18-9-5-2-6-10-18)22(28)25(21)14-16-7-3-1-4-8-16/h1-10,15,17H,11-14H2


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