2-[4-[1-(4-nitrophenyl)sulfanyl-1-sulfanyl-ethyl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[1-(4-nitrophenyl)sulfanyl-1-sulfanyl-ethyl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[1-(4-nitrophenyl)sulfanyl-1-sulfanyl-ethyl]piperazin-1-yl]ethanol CAS Name: 2-[4-[1-mercapto-1-[(4-nitrophenyl)thio]ethyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[1-(4-nitrophenyl)sulfanyl-1-sulfanylethyl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[1-mercapto-1-[(4-nitrophenyl)thio]ethyl]piperazino]ethanol Formula: C14H21N3O3S2 MolecularWeight: 343.46484

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCN(CC1)CCO)(S)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(N1CCN(CC1)CCO)(S)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O3S2/c1-14(21,16-8-6-15(7-9-16)10-11-18)22-13-4-2-12(3-5-13)17(19)20/h2-5,18,21H,6-11H2,1H3