1-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]-2-(1,3-benzoxazol-2-ylsulfanyl)ethanone

Systemtic Name: 1-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]-2-(1,3-benzoxazol-2-ylsulfanyl)ethanone Openeye Name: 1-[4-(benzofuran-2-carbonyl)piperazin-1-yl]-2-(1,3-benzoxazol-2-ylsulfanyl)ethanone CAS Name: 1-[4-[2-benzofuranyl(oxo)methyl]-1-piperazinyl]-2-(1,3-benzoxazol-2-ylthio)ethanone IUPAC Name: 1-[4-(1-benzofuran-2-carbonyl)piperazin-1-yl]-2-(1,3-benzoxazol-2-ylsulfanyl)ethanone Traditional Name: 1-[4-(benzofuran-2-carbonyl)piperazino]-2-(1,3-benzoxazol-2-ylthio)ethanone Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC3=CC=CC=C3O2)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC3=CC=CC=C3O2)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C22H19N3O4S/c26-20(14-30-22-23-16-6-2-4-8-18(16)29-22)24-9-11-25(12-10-24)21(27)19-13-15-5-1-3-7-17(15)28-19/h1-8,13H,9-12,14H2