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8-(3,3-diphenylpropylamino)-3-methyl-7-prop-2-enyl-purine-2,6-dione

8-(3,3-diphenylpropylamino)-3-methyl-7-prop-2-enyl-purine-2,6-dione

Systemtic Name:8-(3,3-diphenylpropylamino)-3-methyl-7-prop-2-enyl-purine-2,6-dione
Openeye Name:7-allyl-8-(3,3-diphenylpropylamino)-3-methyl-purine-2,6-dione
CAS Name:8-(3,3-diphenylpropylamino)-3-methyl-7-prop-2-enylpurine-2,6-dione
IUPAC Name:8-(3,3-diphenylpropylamino)-3-methyl-7-prop-2-enylpurine-2,6-dione
Traditional Name:7-allyl-8-(3,3-diphenylpropylamino)-3-methyl-xanthine
Formula: C24H25N5O2
MolecularWeight: 415.4876
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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCC(C3=CC=CC=C3)C4=CC=CC=C4)CC=C


Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCC(C3=CC=CC=C3)C4=CC=CC=C4)CC=C


InChI

InChI=1S/C24H25N5O2/c1-3-16-29-20-21(28(2)24(31)27-22(20)30)26-23(29)25-15-14-19(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h3-13,19H,1,14-16H2,2H3,(H,25,26)(H,27,30,31)


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