4-nitro-N-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-2,3-dihydro-1H-pyrrol-5-amine

Systemtic Name: 4-nitro-N-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-2,3-dihydro-1H-pyrrol-5-amine Openeye Name: 4-nitro-N-[2-(2-pyridylmethylsulfanyl)ethyl]-2,3-dihydro-1H-pyrrol-5-amine CAS Name: 4-nitro-N-[2-(2-pyridinylmethylthio)ethyl]-2,3-dihydro-1H-pyrrol-5-amine IUPAC Name: 4-nitro-N-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-2,3-dihydro-1H-pyrrol-5-amine Traditional Name: (3-nitro-2-pyrrolin-2-yl)-[2-(2-pyridylmethylthio)ethyl]amine Formula: C12H16N4O2S MolecularWeight: 280.34604

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=C1[N+](=O)[O-])NCCSCC2=CC=CC=N2

Isomeric SMILES

C1CNC(=C1[N+](=O)[O-])NCCSCC2=CC=CC=N2

InChI

InChI=1S/C12H16N4O2S/c17-16(18)11-4-6-14-12(11)15-7-8-19-9-10-3-1-2-5-13-10/h1-3,5,14-15H,4,6-9H2