7-[(2-methyl-5-propan-2-yl-phenoxy)methyl]pyrimido[4,5-d]pyrimidine-2,4-diamine

Systemtic Name: 7-[(2-methyl-5-propan-2-yl-phenoxy)methyl]pyrimido[4,5-d]pyrimidine-2,4-diamine Openeye Name: 7-[(5-isopropyl-2-methyl-phenoxy)methyl]pyrimido[4,5-d]pyrimidine-2,4-diamine CAS Name: 7-[(2-methyl-5-propan-2-ylphenoxy)methyl]pyrimido[4,5-d]pyrimidine-2,4-diamine IUPAC Name: 7-[(2-methyl-5-propan-2-ylphenoxy)methyl]pyrimido[4,5-d]pyrimidine-2,4-diamine Traditional Name: [2-amino-7-[(5-isopropyl-2-methyl-phenoxy)methyl]pyrimido[4,5-d]pyrimidin-4-yl]amine Formula: C17H20N6O MolecularWeight: 324.3803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C)OCC2=NC=C3C(=NC(=NC3=N2)N)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C)OCC2=NC=C3C(=NC(=NC3=N2)N)N

InChI

InChI=1S/C17H20N6O/c1-9(2)11-5-4-10(3)13(6-11)24-8-14-20-7-12-15(18)22-17(19)23-16(12)21-14/h4-7,9H,8H2,1-3H3,(H4,18,19,20,21,22,23)