N-[2-(4-cyclobutylcarbonylpiperazin-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-(4-cyclobutylcarbonylpiperazin-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]-3-fluoranyl-benzamide Openeye Name: N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]-3-fluoro-benzamide CAS Name: N-[2-[4-[cyclobutyl(oxo)methyl]-1-piperazinyl]-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]-3-fluorobenzamide IUPAC Name: N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]-3-fluorobenzamide Traditional Name: N-[2-[4-(cyclobutanecarbonyl)piperazino]-5-(1,4-diazepane-1-carbonyl)phenyl]-3-fluoro-benzamide Formula: C28H34FN5O3 MolecularWeight: 507.599663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CC(=CC=C5)F

Isomeric SMILES

C1CC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C28H34FN5O3/c29-23-7-2-6-21(18-23)26(35)31-24-19-22(28(37)33-12-3-10-30-11-13-33)8-9-25(24)32-14-16-34(17-15-32)27(36)20-4-1-5-20/h2,6-9,18-20,30H,1,3-5,10-17H2,(H,31,35)