(2R,3S)-3-[(5-azanyl-6-chloranyl-2-phenyl-pyrimidin-4-yl)amino]heptan-2-ol

Systemtic Name: (2R,3S)-3-[(5-azanyl-6-chloranyl-2-phenyl-pyrimidin-4-yl)amino]heptan-2-ol Openeye Name: (2R,3S)-3-[(5-amino-6-chloro-2-phenyl-pyrimidin-4-yl)amino]heptan-2-ol CAS Name: (2R,3S)-3-[(5-amino-6-chloro-2-phenyl-4-pyrimidinyl)amino]-2-heptanol IUPAC Name: (2R,3S)-3-[(5-amino-6-chloro-2-phenylpyrimidin-4-yl)amino]heptan-2-ol Traditional Name: (2R,3S)-3-[(5-amino-6-chloro-2-phenyl-pyrimidin-4-yl)amino]heptan-2-ol Formula: C17H23ClN4O MolecularWeight: 334.84372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)O)NC1=C(C(=NC(=N1)C2=CC=CC=C2)Cl)N

Isomeric SMILES

CCCC[C@@H]([C@@H](C)O)NC1=C(C(=NC(=N1)C2=CC=CC=C2)Cl)N

InChI

InChI=1S/C17H23ClN4O/c1-3-4-10-13(11(2)23)20-17-14(19)15(18)21-16(22-17)12-8-6-5-7-9-12/h5-9,11,13,23H,3-4,10,19H2,1-2H3,(H,20,21,22)/t11-,13+/m1/s1