N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-4-oxidanylidene-2,3-dihydrothiochromene-8-carboxamide

Systemtic Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-4-oxidanylidene-2,3-dihydrothiochromene-8-carboxamide Openeye Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-4-oxo-thiochromane-8-carboxamide CAS Name: N-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-4-oxo-2,3-dihydro-1-benzothiopyran-8-carboxamide IUPAC Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-4-oxo-2,3-dihydrothiochromene-8-carboxamide Traditional Name: N-[3-[4-(4-fluorophenyl)piperazino]propyl]-4-keto-thiochroman-8-carboxamide Formula: C23H26FN3O2S MolecularWeight: 427.534843

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1=O)C=CC=C2C(=O)NCCCN3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CSC2=C(C1=O)C=CC=C2C(=O)NCCCN3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN3O2S/c24-17-5-7-18(8-6-17)27-14-12-26(13-15-27)11-2-10-25-23(29)20-4-1-3-19-21(28)9-16-30-22(19)20/h1,3-8H,2,9-16H2,(H,25,29)