4-[(E)-3-[4-(2-cyano-3-fluoranyl-phenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-N-methyl-benzamide

Systemtic Name: 4-[(E)-3-[4-(2-cyano-3-fluoranyl-phenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-N-methyl-benzamide Openeye Name: 4-[(E)-3-[4-(2-cyano-3-fluoro-phenyl)piperazin-1-yl]-3-oxo-prop-1-enyl]-N-methyl-benzamide CAS Name: 4-[(E)-3-[4-(2-cyano-3-fluorophenyl)-1-piperazinyl]-3-oxoprop-1-enyl]-N-methylbenzamide IUPAC Name: 4-[(E)-3-[4-(2-cyano-3-fluorophenyl)piperazin-1-yl]-3-oxoprop-1-enyl]-N-methylbenzamide Traditional Name: 4-[(E)-3-[4-(2-cyano-3-fluoro-phenyl)piperazino]-3-keto-prop-1-enyl]-N-methyl-benzamide Formula: C22H21FN4O2 MolecularWeight: 392.426143

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C3=C(C(=CC=C3)F)C#N

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=C(C(=CC=C3)F)C#N

InChI

InChI=1S/C22H21FN4O2/c1-25-22(29)17-8-5-16(6-9-17)7-10-21(28)27-13-11-26(12-14-27)20-4-2-3-19(23)18(20)15-24/h2-10H,11-14H2,1H3,(H,25,29)/b10-7+