1-(4-bromophenyl)-N-(3-ethyl-2-morpholin-4-yl-pentyl)-5-methyl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)-N-(3-ethyl-2-morpholin-4-yl-pentyl)-5-methyl-pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-N-(3-ethyl-2-morpholino-pentyl)-5-methyl-pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-N-[3-ethyl-2-(4-morpholinyl)pentyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)-5-methylpyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-N-(3-ethyl-2-morpholino-pentyl)-5-methyl-pyrazole-4-carboxamide Formula: C22H31BrN4O2 MolecularWeight: 463.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)Br)C)N3CCOCC3

Isomeric SMILES

CCC(CC)C(CNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)Br)C)N3CCOCC3

InChI

InChI=1S/C22H31BrN4O2/c1-4-17(5-2)21(26-10-12-29-13-11-26)15-24-22(28)20-14-25-27(16(20)3)19-8-6-18(23)7-9-19/h6-9,14,17,21H,4-5,10-13,15H2,1-3H3,(H,24,28)