[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-chloranylpropanoate

Systemtic Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-chloranylpropanoate Openeye Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-chloropropanoate CAS Name: 3-chloropropanoic acid [4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 3-chloropropanoate Traditional Name: 3-chloropropionic acid [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C20H18ClN3O2 MolecularWeight: 367.82882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)CCCl)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)CCCl)C3=CC=CC=C3

InChI

InChI=1S/C20H18ClN3O2/c1-14-22-18(15-5-3-2-4-6-15)13-19(23-14)24-16-7-9-17(10-8-16)26-20(25)11-12-21/h2-10,13H,11-12H2,1H3,(H,22,23,24)