2-(hexylamino)-7-phenyl-8H-pyrimido[4,5-d]pyrimidin-5-one

Systemtic Name: 2-(hexylamino)-7-phenyl-8H-pyrimido[4,5-d]pyrimidin-5-one Openeye Name: 2-(hexylamino)-7-phenyl-8H-pyrimido[4,5-d]pyrimidin-5-one CAS Name: 2-(hexylamino)-7-phenyl-8H-pyrimido[4,5-d]pyrimidin-5-one IUPAC Name: 2-(hexylamino)-7-phenyl-8H-pyrimido[4,5-d]pyrimidin-5-one Traditional Name: 2-(hexylamino)-7-phenyl-8H-pyrimido[4,5-d]pyrimidin-5-one Formula: C18H21N5O MolecularWeight: 323.39224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC=C2C(=N1)NC(=NC2=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCNC1=NC=C2C(=N1)NC(=NC2=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N5O/c1-2-3-4-8-11-19-18-20-12-14-16(23-18)21-15(22-17(14)24)13-9-6-5-7-10-13/h5-7,9-10,12H,2-4,8,11H2,1H3,(H2,19,20,21,22,23,24)