N-[6-(4-cyanophenyl)-5-methyl-pyridin-3-yl]-6-fluoranyl-5-(3,4,5-trimethylpiperazin-1-yl)-1-benzofuran-3-carboxamide

Systemtic Name: N-[6-(4-cyanophenyl)-5-methyl-pyridin-3-yl]-6-fluoranyl-5-(3,4,5-trimethylpiperazin-1-yl)-1-benzofuran-3-carboxamide Openeye Name: N-[6-(4-cyanophenyl)-5-methyl-3-pyridyl]-6-fluoro-5-(3,4,5-trimethylpiperazin-1-yl)benzofuran-3-carboxamide CAS Name: N-[6-(4-cyanophenyl)-5-methyl-3-pyridinyl]-6-fluoro-5-(3,4,5-trimethyl-1-piperazinyl)-3-benzofurancarboxamide IUPAC Name: N-[6-(4-cyanophenyl)-5-methylpyridin-3-yl]-6-fluoro-5-(3,4,5-trimethylpiperazin-1-yl)-1-benzofuran-3-carboxamide Traditional Name: N-[6-(4-cyanophenyl)-5-methyl-3-pyridyl]-6-fluoro-5-(3,4,5-trimethylpiperazino)benzofuran-3-carboxamide Formula: C29H28FN5O2 MolecularWeight: 497.563323

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C)C)C2=C(C=C3C(=C2)C(=CO3)C(=O)NC4=CN=C(C(=C4)C)C5=CC=C(C=C5)C#N)F

Isomeric SMILES

CC1CN(CC(N1C)C)C2=C(C=C3C(=C2)C(=CO3)C(=O)NC4=CN=C(C(=C4)C)C5=CC=C(C=C5)C#N)F

InChI

InChI=1S/C29H28FN5O2/c1-17-9-22(13-32-28(17)21-7-5-20(12-31)6-8-21)33-29(36)24-16-37-27-11-25(30)26(10-23(24)27)35-14-18(2)34(4)19(3)15-35/h5-11,13,16,18-19H,14-15H2,1-4H3,(H,33,36)