N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-propan-2-yl-pyrimido[5,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-propan-2-yl-pyrimido[5,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-isopropyl-pyrimido[5,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-propan-2-ylpyrimido[5,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-propan-2-ylpyrimido[5,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(3-chloro-4-fluoro-anilino)pyrimido[5,4-d]pyrimidin-6-yl]-isopropyl-amine Formula: C15H14ClFN6 MolecularWeight: 332.763263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=C2C(=N1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C)NC1=NC=C2C(=N1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C15H14ClFN6/c1-8(2)21-15-18-6-12-13(23-15)14(20-7-19-12)22-9-3-4-11(17)10(16)5-9/h3-8H,1-2H3,(H,18,21,23)(H,19,20,22)