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

Systemtic Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanylmethyl]pyridin-3-ol Openeye Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanylmethyl]pyridin-3-ol CAS Name: 2-[[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylthio]methyl]-3-pyridinol IUPAC Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanylmethyl]pyridin-3-ol Traditional Name: 2-[[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylthio]methyl]pyridin-3-ol Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O3S/c17-11-2-1-4-13-9(11)8-20-7-6-15-12-10(16(18)19)3-5-14-12/h1-5,14-15,17H,6-8H2