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2-azanyl-1-[1-[(phenylmethyl)amino]dodecyl]-7H-purin-6-one

2-azanyl-1-[1-[(phenylmethyl)amino]dodecyl]-7H-purin-6-one

Systemtic Name:2-azanyl-1-[1-[(phenylmethyl)amino]dodecyl]-7H-purin-6-one
Openeye Name:2-amino-1-[1-(benzylamino)dodecyl]-7H-purin-6-one
CAS Name:2-amino-1-[1-[(phenylmethyl)amino]dodecyl]-7H-purin-6-one
IUPAC Name:2-amino-1-[1-(benzylamino)dodecyl]-7H-purin-6-one
Traditional Name:2-amino-1-[1-(benzylamino)dodecyl]-7H-purin-6-one
Formula: C24H36N6O
MolecularWeight: 424.58224
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(NCC1=CC=CC=C1)N2C(=O)C3=C(N=CN3)N=C2N


Isomeric SMILES

CCCCCCCCCCCC(NCC1=CC=CC=C1)N2C(=O)C3=C(N=CN3)N=C2N


InChI

InChI=1S/C24H36N6O/c1-2-3-4-5-6-7-8-9-13-16-20(26-17-19-14-11-10-12-15-19)30-23(31)21-22(28-18-27-21)29-24(30)25/h10-12,14-15,18,20,26H,2-9,13,16-17H2,1H3,(H2,25,29)(H,27,28)


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