N-[3-[[2-[(6-bromanylpyridin-3-yl)amino]-5-cyclopropyl-pyrimidin-4-yl]amino]propyl]cyclobutanecarboxamide

Systemtic Name: N-[3-[[2-[(6-bromanylpyridin-3-yl)amino]-5-cyclopropyl-pyrimidin-4-yl]amino]propyl]cyclobutanecarboxamide Openeye Name: N-[3-[[2-[(6-bromo-3-pyridyl)amino]-5-cyclopropyl-pyrimidin-4-yl]amino]propyl]cyclobutanecarboxamide CAS Name: N-[3-[[2-[(6-bromo-3-pyridinyl)amino]-5-cyclopropyl-4-pyrimidinyl]amino]propyl]cyclobutanecarboxamide IUPAC Name: N-[3-[[2-[(6-bromopyridin-3-yl)amino]-5-cyclopropylpyrimidin-4-yl]amino]propyl]cyclobutanecarboxamide Traditional Name: N-[3-[[2-[(6-bromo-3-pyridyl)amino]-5-cyclopropyl-pyrimidin-4-yl]amino]propyl]cyclobutanecarboxamide Formula: C20H25BrN6O MolecularWeight: 445.3561

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NCCCNC2=NC(=NC=C2C3CC3)NC4=CN=C(C=C4)Br

Isomeric SMILES

C1CC(C1)C(=O)NCCCNC2=NC(=NC=C2C3CC3)NC4=CN=C(C=C4)Br

InChI

InChI=1S/C20H25BrN6O/c21-17-8-7-15(11-24-17)26-20-25-12-16(13-5-6-13)18(27-20)22-9-2-10-23-19(28)14-3-1-4-14/h7-8,11-14H,1-6,9-10H2,(H,23,28)(H2,22,25,26,27)