N-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyrimidin-2-yl]-3-methyl-butanamide

Systemtic Name: N-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyrimidin-2-yl]-3-methyl-butanamide Openeye Name: N-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyrimidin-2-yl]-3-methyl-butanamide CAS Name: N-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)-2-pyrimidinyl]-3-methylbutanamide IUPAC Name: N-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyrimidin-2-yl]-3-methylbutanamide Traditional Name: N-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyrimidin-2-yl]-3-methyl-butyramide Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=NC(=CC(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)CC(=O)NC1=NC(=CC(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22ClN3O2/c1-14(2)12-21(27)26-22-24-19(15-4-8-17(23)9-5-15)13-20(25-22)16-6-10-18(28-3)11-7-16/h4-11,13-14H,12H2,1-3H3,(H,24,25,26,27)