N-[2-[(3-methylpyridin-2-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine

Systemtic Name: N-[2-[(3-methylpyridin-2-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine Openeye Name: N-[2-[(3-methyl-2-pyridyl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine CAS Name: N-[2-[(3-methyl-2-pyridinyl)methylthio]ethyl]-3-nitro-1H-pyrrol-2-amine IUPAC Name: N-[2-[(3-methylpyridin-2-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine Traditional Name: 2-[(3-methyl-2-pyridyl)methylthio]ethyl-(3-nitro-1H-pyrrol-2-yl)amine Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CSCCNC2=C(C=CN2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=CC=C1)CSCCNC2=C(C=CN2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O2S/c1-10-3-2-5-14-11(10)9-20-8-7-16-13-12(17(18)19)4-6-15-13/h2-6,15-16H,7-9H2,1H3