N-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-5-methyl-2-phenyl-pyrrol-1-yl]pyridine-4-carboxamide

Systemtic Name: N-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-5-methyl-2-phenyl-pyrrol-1-yl]pyridine-4-carboxamide Openeye Name: N-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-5-methyl-2-phenyl-pyrrol-1-yl]pyridine-4-carboxamide CAS Name: N-[3-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-5-methyl-2-phenyl-1-pyrrolyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-5-methyl-2-phenylpyrrol-1-yl]pyridine-4-carboxamide Traditional Name: N-[3-[[4-(4-fluorophenyl)piperazino]methyl]-5-methyl-2-phenyl-pyrrol-1-yl]isonicotinamide Formula: C28H28FN5O MolecularWeight: 469.553223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1NC(=O)C2=CC=NC=C2)C3=CC=CC=C3)CN4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC(=C(N1NC(=O)C2=CC=NC=C2)C3=CC=CC=C3)CN4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H28FN5O/c1-21-19-24(20-32-15-17-33(18-16-32)26-9-7-25(29)8-10-26)27(22-5-3-2-4-6-22)34(21)31-28(35)23-11-13-30-14-12-23/h2-14,19H,15-18,20H2,1H3,(H,31,35)