N-(5-bromanyl-2-morpholin-4-yl-phenyl)-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-(5-bromanyl-2-morpholin-4-yl-phenyl)-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-(5-bromo-2-morpholino-phenyl)-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[5-bromo-2-(4-morpholinyl)phenyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-(5-bromo-2-morpholin-4-ylphenyl)-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-(5-bromo-2-morpholino-phenyl)-3-(1-phenylpyrazol-4-yl)propionamide Formula: C22H23BrN4O2 MolecularWeight: 455.34762

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Br)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Br)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23BrN4O2/c23-18-7-8-21(26-10-12-29-13-11-26)20(14-18)25-22(28)9-6-17-15-24-27(16-17)19-4-2-1-3-5-19/h1-5,7-8,14-16H,6,9-13H2,(H,25,28)