1-[4-[1-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]propyl]phenoxy]propan-2-one

Systemtic Name: 1-[4-[1-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]propyl]phenoxy]propan-2-one Openeye Name: 1-[4-[1-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]propyl]phenoxy]propan-2-one CAS Name: 1-[4-[1-[(5-chloro-6-ethyl-4-pyrimidinyl)amino]propyl]phenoxy]-2-propanone IUPAC Name: 1-[4-[1-[(5-chloro-6-ethylpyrimidin-4-yl)amino]propyl]phenoxy]propan-2-one Traditional Name: 1-[4-[1-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]propyl]phenoxy]acetone Formula: C18H22ClN3O2 MolecularWeight: 347.83918

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=N1)NC(CC)C2=CC=C(C=C2)OCC(=O)C)Cl

Isomeric SMILES

CCC1=C(C(=NC=N1)NC(CC)C2=CC=C(C=C2)OCC(=O)C)Cl

InChI

InChI=1S/C18H22ClN3O2/c1-4-15(22-18-17(19)16(5-2)20-11-21-18)13-6-8-14(9-7-13)24-10-12(3)23/h6-9,11,15H,4-5,10H2,1-3H3,(H,20,21,22)