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

Systemtic Name: N-[3-(azepan-1-yl)propyl]-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-1-(4-fluorophenyl)-3-methyl-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C24H30FN5O MolecularWeight: 423.526303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCCN2CCCCCC2)N3C=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCCN2CCCCCC2)N3C=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H30FN5O/c1-19-22(23(31)26-13-8-16-28-14-4-2-3-5-15-28)24(29-17-6-7-18-29)30(27-19)21-11-9-20(25)10-12-21/h6-7,9-12,17-18H,2-5,8,13-16H2,1H3,(H,26,31)