4-fluoranyl-3-(phenoxymethyl)-N-[2-(pyrazin-2-ylamino)ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-3-(phenoxymethyl)-N-[2-(pyrazin-2-ylamino)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-3-(phenoxymethyl)-N-[2-(pyrazin-2-ylamino)ethyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-3-(phenoxymethyl)-N-[2-(2-pyrazinylamino)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-3-(phenoxymethyl)-N-[2-(pyrazin-2-ylamino)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-3-(phenoxymethyl)-N-[2-(pyrazin-2-ylamino)ethyl]benzothiophene-2-carboxamide Formula: C22H19FN4O2S MolecularWeight: 422.475263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=C(SC3=CC=CC(=C32)F)C(=O)NCCNC4=NC=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)OCC2=C(SC3=CC=CC(=C32)F)C(=O)NCCNC4=NC=CN=C4

InChI

InChI=1S/C22H19FN4O2S/c23-17-7-4-8-18-20(17)16(14-29-15-5-2-1-3-6-15)21(30-18)22(28)27-12-11-26-19-13-24-9-10-25-19/h1-10,13H,11-12,14H2,(H,25,26)(H,27,28)