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

Systemtic Name: N-[3-[ethyl-(phenylmethyl)amino]propyl]-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-[benzyl(ethyl)amino]propyl]-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[3-[ethyl-(phenylmethyl)amino]propyl]-1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-[benzyl(ethyl)amino]propyl]-1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-[benzyl(ethyl)amino]propyl]-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C26H28FN5O MolecularWeight: 445.531823

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)F)N3C=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCN(CCCNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)F)N3C=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H28FN5O/c1-2-30(20-21-9-4-3-5-10-21)16-8-15-28-25(33)24-19-29-32(23-13-11-22(27)12-14-23)26(24)31-17-6-7-18-31/h3-7,9-14,17-19H,2,8,15-16,20H2,1H3,(H,28,33)