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

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(1,3-benzoxazol-2-ylsulfanyl)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(1,3-benzoxazol-2-ylthio)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(1,3-benzoxazol-2-ylsulfanyl)ethanone Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-1-(4-besylpiperazino)ethanone Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H19N3O4S2/c23-18(14-27-19-20-16-8-4-5-9-17(16)26-19)21-10-12-22(13-11-21)28(24,25)15-6-2-1-3-7-15/h1-9H,10-14H2