(5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-yl)diazane

Systemtic Name: (5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-yl)diazane Openeye Name: [5-nitro-6-(8-quinolylsulfanyl)pyrimidin-4-yl]hydrazine CAS Name: [5-nitro-6-(8-quinolinylthio)-4-pyrimidinyl]hydrazine IUPAC Name: (5-nitro-6-quinolin-8-ylsulfanylpyrimidin-4-yl)hydrazine Traditional Name: [5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]hydrazine Formula: C13H10N6O2S MolecularWeight: 314.3225

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SC3=NC=NC(=C3[N+](=O)[O-])NN)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)SC3=NC=NC(=C3[N+](=O)[O-])NN)N=CC=C2

InChI

InChI=1S/C13H10N6O2S/c14-18-12-11(19(20)21)13(17-7-16-12)22-9-5-1-3-8-4-2-6-15-10(8)9/h1-7H,14H2,(H,16,17,18)