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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=C(C=C(C=C4)C#N)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=C(C=C(C=C4)C#N)F

InChI

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