azepan-1-yl-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]methanone CAS Name: 1-azepanyl-[1-(4-fluorophenyl)-3-methyl-5-(1-pyrrolyl)-4-pyrazolyl]methanone IUPAC Name: azepan-1-yl-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-ylpyrazol-4-yl]methanone Traditional Name: azepan-1-yl-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]methanone Formula: C21H23FN4O MolecularWeight: 366.431923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCCCCC2)N3C=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCCCCC2)N3C=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H23FN4O/c1-16-19(21(27)25-14-4-2-3-5-15-25)20(24-12-6-7-13-24)26(23-16)18-10-8-17(22)9-11-18/h6-13H,2-5,14-15H2,1H3