3-[4-[4-(2-cyano-3-fluoranyl-phenyl)piperazin-1-yl]butyl]-1H-indole-5-carboxamide

Systemtic Name: 3-[4-[4-(2-cyano-3-fluoranyl-phenyl)piperazin-1-yl]butyl]-1H-indole-5-carboxamide Openeye Name: 3-[4-[4-(2-cyano-3-fluoro-phenyl)piperazin-1-yl]butyl]-1H-indole-5-carboxamide CAS Name: 3-[4-[4-(2-cyano-3-fluorophenyl)-1-piperazinyl]butyl]-1H-indole-5-carboxamide IUPAC Name: 3-[4-[4-(2-cyano-3-fluorophenyl)piperazin-1-yl]butyl]-1H-indole-5-carboxamide Traditional Name: 3-[4-[4-(2-cyano-3-fluoro-phenyl)piperazino]butyl]-1H-indole-5-carboxamide Formula: C24H26FN5O MolecularWeight: 419.494543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C(=O)N)C4=C(C(=CC=C4)F)C#N

Isomeric SMILES

C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C(=O)N)C4=C(C(=CC=C4)F)C#N

InChI

InChI=1S/C24H26FN5O/c25-21-5-3-6-23(20(21)15-26)30-12-10-29(11-13-30)9-2-1-4-18-16-28-22-8-7-17(24(27)31)14-19(18)22/h3,5-8,14,16,28H,1-2,4,9-13H2,(H2,27,31)