N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-4-cyano-2-fluoranyl-benzamide

Systemtic Name: N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-4-cyano-2-fluoranyl-benzamide Openeye Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-4-cyano-2-fluoro-benzamide CAS Name: N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-4-cyano-2-fluorobenzamide IUPAC Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-4-cyano-2-fluorobenzamide Traditional Name: N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]-4-cyano-2-fluoro-benzamide Formula: C26H22ClFN4O2 MolecularWeight: 476.929883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=C(C=C(C=C4)C#N)F)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=C(C=C(C=C4)C#N)F)Cl

InChI

InChI=1S/C26H22ClFN4O2/c1-17-4-2-3-5-20(17)26(34)32-12-10-31(11-13-32)24-9-7-19(15-22(24)27)30-25(33)21-8-6-18(16-29)14-23(21)28/h2-9,14-15H,10-13H2,1H3,(H,30,33)