2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanylmethyl]pyridin-3-amine

Systemtic Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanylmethyl]pyridin-3-amine Openeye Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanylmethyl]pyridin-3-amine CAS Name: 2-[[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylthio]methyl]-3-pyridinamine IUPAC Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanylmethyl]pyridin-3-amine Traditional Name: 2-[(3-amino-2-pyridyl)methylthio]ethyl-(3-nitro-1H-pyrrol-2-yl)amine Formula: C12H15N5O2S MolecularWeight: 293.3448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N5O2S/c13-9-2-1-4-14-10(9)8-20-7-6-16-12-11(17(18)19)3-5-15-12/h1-5,15-16H,6-8,13H2