1-[4-[4-(2-methoxy-4-methylsulfanyl-phenyl)carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(2-methoxy-4-methylsulfanyl-phenyl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(2-methoxy-4-methylsulfanyl-benzoyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(2-methoxy-4-methylsulfanylbenzoyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[2-methoxy-4-(methylthio)benzoyl]piperazino]phenyl]ethanone Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)SC)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)SC)OC

InChI

InChI=1S/C21H24N2O3S/c1-15(24)16-4-6-17(7-5-16)22-10-12-23(13-11-22)21(25)19-9-8-18(27-3)14-20(19)26-2/h4-9,14H,10-13H2,1-3H3