2-chloranyl-5-[3-[(4-cyanophenyl)carbonylamino]phenyl]-3-fluoranyl-4-(4-methylpiperazin-1-yl)benzamide

Systemtic Name: 2-chloranyl-5-[3-[(4-cyanophenyl)carbonylamino]phenyl]-3-fluoranyl-4-(4-methylpiperazin-1-yl)benzamide Openeye Name: 2-chloro-5-[3-[(4-cyanobenzoyl)amino]phenyl]-3-fluoro-4-(4-methylpiperazin-1-yl)benzamide CAS Name: 2-chloro-5-[3-[[(4-cyanophenyl)-oxomethyl]amino]phenyl]-3-fluoro-4-(4-methyl-1-piperazinyl)benzamide IUPAC Name: 2-chloro-5-[3-[(4-cyanobenzoyl)amino]phenyl]-3-fluoro-4-(4-methylpiperazin-1-yl)benzamide Traditional Name: 2-chloro-5-[3-[(4-cyanobenzoyl)amino]phenyl]-3-fluoro-4-(4-methylpiperazino)benzamide Formula: C26H23ClFN5O2 MolecularWeight: 491.944523

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=C(C=C2C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)C#N)C(=O)N)Cl)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=C(C=C2C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)C#N)C(=O)N)Cl)F

InChI

InChI=1S/C26H23ClFN5O2/c1-32-9-11-33(12-10-32)24-20(14-21(25(30)34)22(27)23(24)28)18-3-2-4-19(13-18)31-26(35)17-7-5-16(15-29)6-8-17/h2-8,13-14H,9-12H2,1H3,(H2,30,34)(H,31,35)