N-[2-(4-ethylpiperazin-1-yl)phenyl]-5-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-5-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-5-fluoro-benzothiophene-2-carboxamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)phenyl]-5-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-5-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(4-ethylpiperazino)phenyl]-5-fluoro-benzothiophene-2-carboxamide Formula: C21H22FN3OS MolecularWeight: 383.482283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC4=C(S3)C=CC(=C4)F

Isomeric SMILES

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC4=C(S3)C=CC(=C4)F

InChI

InChI=1S/C21H22FN3OS/c1-2-24-9-11-25(12-10-24)18-6-4-3-5-17(18)23-21(26)20-14-15-13-16(22)7-8-19(15)27-20/h3-8,13-14H,2,9-12H2,1H3,(H,23,26)