4-fluoranyl-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[4-(4-methylpiperazino)sulfonylphenyl]benzothiophene-2-carboxamide Formula: C20H20FN3O3S2 MolecularWeight: 433.519503

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C20H20FN3O3S2/c1-23-9-11-24(12-10-23)29(26,27)15-7-5-14(6-8-15)22-20(25)19-13-16-17(21)3-2-4-18(16)28-19/h2-8,13H,9-12H2,1H3,(H,22,25)