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

Systemtic Name: N-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-methyl-5-phenyl-pyrrol-1-yl]pyrazine-2-carboxamide Openeye Name: N-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-methyl-5-phenyl-pyrrol-1-yl]pyrazine-2-carboxamide CAS Name: N-[3-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-2-methyl-5-phenyl-1-pyrrolyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-methyl-5-phenylpyrrol-1-yl]pyrazine-2-carboxamide Traditional Name: N-[3-[[4-(4-fluorophenyl)piperazino]methyl]-2-methyl-5-phenyl-pyrrol-1-yl]pyrazinamide Formula: C27H27FN6O MolecularWeight: 470.541283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27FN6O/c1-20-22(19-32-13-15-33(16-14-32)24-9-7-23(28)8-10-24)17-26(21-5-3-2-4-6-21)34(20)31-27(35)25-18-29-11-12-30-25/h2-12,17-18H,13-16,19H2,1H3,(H,31,35)