3-[2,6-bis(azanyl)pyrimidin-4-yl]-1-phenyl-prop-2-yn-1-ol

Systemtic Name: 3-[2,6-bis(azanyl)pyrimidin-4-yl]-1-phenyl-prop-2-yn-1-ol Openeye Name: 3-(2,6-diaminopyrimidin-4-yl)-1-phenyl-prop-2-yn-1-ol CAS Name: 3-(2,6-diamino-4-pyrimidinyl)-1-phenyl-2-propyn-1-ol IUPAC Name: 3-(2,6-diaminopyrimidin-4-yl)-1-phenylprop-2-yn-1-ol Traditional Name: 3-(2,6-diaminopyrimidin-4-yl)-1-phenyl-prop-2-yn-1-ol Formula: C13H12N4O MolecularWeight: 240.26058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#CC2=CC(=NC(=N2)N)N)O

Isomeric SMILES

C1=CC=C(C=C1)C(C#CC2=CC(=NC(=N2)N)N)O

InChI

InChI=1S/C13H12N4O/c14-12-8-10(16-13(15)17-12)6-7-11(18)9-4-2-1-3-5-9/h1-5,8,11,18H,(H4,14,15,16,17)