3-(1-benzofuran-2-yl)-1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]but-2-en-1-one

Systemtic Name: 3-(1-benzofuran-2-yl)-1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]but-2-en-1-one Openeye Name: 3-(benzofuran-2-yl)-1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]but-2-en-1-one CAS Name: 3-(2-benzofuranyl)-1-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-2-buten-1-one IUPAC Name: 3-(1-benzofuran-2-yl)-1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]but-2-en-1-one Traditional Name: 3-(benzofuran-2-yl)-1-[4-(1,2-benzothiazol-3-yl)piperazino]but-2-en-1-one Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCN(CC1)C2=NSC3=CC=CC=C32)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC(=CC(=O)N1CCN(CC1)C2=NSC3=CC=CC=C32)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C23H21N3O2S/c1-16(20-15-17-6-2-4-8-19(17)28-20)14-22(27)25-10-12-26(13-11-25)23-18-7-3-5-9-21(18)29-24-23/h2-9,14-15H,10-13H2,1H3