2-[[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one

Systemtic Name: 2-[[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Openeye Name: 2-[[4-(benzofuran-2-carbonyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one CAS Name: 2-[[4-[2-benzofuranyl(oxo)methyl]-1-piperazinyl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one IUPAC Name: 2-[[4-(1-benzofuran-2-carbonyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Traditional Name: 2-[[4-(benzofuran-2-carbonyl)piperazino]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)SC(=N2)CN3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CC2=C(C(=O)C1)SC(=N2)CN3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C21H21N3O3S/c25-16-6-3-5-15-20(16)28-19(22-15)13-23-8-10-24(11-9-23)21(26)18-12-14-4-1-2-7-17(14)27-18/h1-2,4,7,12H,3,5-6,8-11,13H2