1-[4-[4-chloranyl-2-(methylamino)pyrimidin-5-yl]phenoxy]-1-pyridin-3-yl-pentan-3-ol

Systemtic Name: 1-[4-[4-chloranyl-2-(methylamino)pyrimidin-5-yl]phenoxy]-1-pyridin-3-yl-pentan-3-ol Openeye Name: 1-[4-[4-chloro-2-(methylamino)pyrimidin-5-yl]phenoxy]-1-(3-pyridyl)pentan-3-ol CAS Name: 1-[4-[4-chloro-2-(methylamino)-5-pyrimidinyl]phenoxy]-1-(3-pyridinyl)-3-pentanol IUPAC Name: 1-[4-[4-chloro-2-(methylamino)pyrimidin-5-yl]phenoxy]-1-pyridin-3-ylpentan-3-ol Traditional Name: 1-[4-[4-chloro-2-(methylamino)pyrimidin-5-yl]phenoxy]-1-(3-pyridyl)pentan-3-ol Formula: C21H23ClN4O2 MolecularWeight: 398.88592

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C1=CN=CC=C1)OC2=CC=C(C=C2)C3=CN=C(N=C3Cl)NC)O

Isomeric SMILES

CCC(CC(C1=CN=CC=C1)OC2=CC=C(C=C2)C3=CN=C(N=C3Cl)NC)O

InChI

InChI=1S/C21H23ClN4O2/c1-3-16(27)11-19(15-5-4-10-24-12-15)28-17-8-6-14(7-9-17)18-13-25-21(23-2)26-20(18)22/h4-10,12-13,16,19,27H,3,11H2,1-2H3,(H,23,25,26)