N-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethyl]-4-nitro-2,3-dihydro-1H-pyrrol-5-amine

Systemtic Name: N-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethyl]-4-nitro-2,3-dihydro-1H-pyrrol-5-amine Openeye Name: N-[2-[(3-methoxy-2-pyridyl)methylsulfanyl]ethyl]-4-nitro-2,3-dihydro-1H-pyrrol-5-amine CAS Name: N-[2-[(3-methoxy-2-pyridinyl)methylthio]ethyl]-4-nitro-2,3-dihydro-1H-pyrrol-5-amine IUPAC Name: N-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethyl]-4-nitro-2,3-dihydro-1H-pyrrol-5-amine Traditional Name: 2-[(3-methoxy-2-pyridyl)methylthio]ethyl-(3-nitro-2-pyrrolin-2-yl)amine Formula: C13H18N4O3S MolecularWeight: 310.37202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=CC=C1)CSCCNC2=C(CCN2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(N=CC=C1)CSCCNC2=C(CCN2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O3S/c1-20-12-3-2-5-14-10(12)9-21-8-7-16-13-11(17(18)19)4-6-15-13/h2-3,5,15-16H,4,6-9H2,1H3