3-bromanyl-5-methoxy-4-propoxy-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]benzamide

Systemtic Name: 3-bromanyl-5-methoxy-4-propoxy-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]benzamide Openeye Name: 3-bromo-5-methoxy-4-propoxy-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]benzamide CAS Name: 3-bromo-5-methoxy-4-propoxy-N-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]benzamide IUPAC Name: 3-bromo-5-methoxy-4-propoxy-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]benzamide Traditional Name: 3-bromo-5-methoxy-4-propoxy-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]benzamide Formula: C20H21BrN4O3 MolecularWeight: 445.30974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)NCC2=CN=C(C=C2)N3C=CC=N3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)NCC2=CN=C(C=C2)N3C=CC=N3)OC

InChI

InChI=1S/C20H21BrN4O3/c1-3-9-28-19-16(21)10-15(11-17(19)27-2)20(26)23-13-14-5-6-18(22-12-14)25-8-4-7-24-25/h4-8,10-12H,3,9,13H2,1-2H3,(H,23,26)