1-[4-[4-[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[oxo-[2-(2-oxolanylmethylthio)phenyl]methyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[2-(oxolan-2-ylmethylsulfanyl)benzoyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[2-(tetrahydrofurfurylthio)benzoyl]piperazino]phenyl]ethanone Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC4CCCO4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC4CCCO4

InChI

InChI=1S/C24H28N2O3S/c1-18(27)19-8-10-20(11-9-19)25-12-14-26(15-13-25)24(28)22-6-2-3-7-23(22)30-17-21-5-4-16-29-21/h2-3,6-11,21H,4-5,12-17H2,1H3