2-[(2R)-4-methylsulfanyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)butan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2R)-4-methylsulfanyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)butan-2-yl]isoindole-1,3-dione Openeye Name: 2-[(1R)-3-methylsulfanyl-1-(4-phenylpiperazine-1-carbonyl)propyl]isoindoline-1,3-dione CAS Name: 2-[(2R)-4-(methylthio)-1-oxo-1-(4-phenyl-1-piperazinyl)butan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[(2R)-4-methylsulfanyl-1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]isoindole-1,3-dione Traditional Name: 2-[(1R)-3-(methylthio)-1-(4-phenylpiperazine-1-carbonyl)propyl]isoindoline-1,3-quinone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CSCC[C@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H25N3O3S/c1-30-16-11-20(26-21(27)18-9-5-6-10-19(18)22(26)28)23(29)25-14-12-24(13-15-25)17-7-3-2-4-8-17/h2-10,20H,11-16H2,1H3/t20-/m1/s1