N-[3-[butyl(methyl)amino]propyl]-1-(3-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[3-[butyl(methyl)amino]propyl]-1-(3-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-[butyl(methyl)amino]propyl]-1-(3-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[3-[butyl(methyl)amino]propyl]-1-(3-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-[butyl(methyl)amino]propyl]-1-(3-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-[butyl(methyl)amino]propyl]-1-(3-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C22H28FN5O MolecularWeight: 397.489023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)CCCNC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)F)N3C=CC=C3

Isomeric SMILES

CCCCN(C)CCCNC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)F)N3C=CC=C3

InChI

InChI=1S/C22H28FN5O/c1-3-4-12-26(2)13-8-11-24-21(29)20-17-25-28(19-10-7-9-18(23)16-19)22(20)27-14-5-6-15-27/h5-7,9-10,14-17H,3-4,8,11-13H2,1-2H3,(H,24,29)