3-bromanyl-5-methoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-5-methoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]-4-propoxy-benzamide Openeye Name: 3-bromo-5-methoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]-4-propoxy-benzamide CAS Name: 3-bromo-5-methoxy-N-[3-(2-methyl-4-pyrimidinyl)phenyl]-4-propoxybenzamide IUPAC Name: 3-bromo-5-methoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]-4-propoxybenzamide Traditional Name: 3-bromo-5-methoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]-4-propoxy-benzamide Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C)OC

InChI

InChI=1S/C22H22BrN3O3/c1-4-10-29-21-18(23)12-16(13-20(21)28-3)22(27)26-17-7-5-6-15(11-17)19-8-9-24-14(2)25-19/h5-9,11-13H,4,10H2,1-3H3,(H,26,27)