N'-(5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-yl)-2,2-diphenyl-ethanehydrazide

Systemtic Name: N'-(5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-yl)-2,2-diphenyl-ethanehydrazide Openeye Name: N'-[5-nitro-6-(8-quinolylsulfanyl)pyrimidin-4-yl]-2,2-diphenyl-acetohydrazide CAS Name: N'-[5-nitro-6-(8-quinolinylthio)-4-pyrimidinyl]-2,2-diphenylacetohydrazide IUPAC Name: N'-(5-nitro-6-quinolin-8-ylsulfanylpyrimidin-4-yl)-2,2-diphenylacetohydrazide Traditional Name: N'-[5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]-2,2-diphenyl-acetohydrazide Formula: C27H20N6O3S MolecularWeight: 508.5511

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NNC3=C(C(=NC=N3)SC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NNC3=C(C(=NC=N3)SC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H20N6O3S/c34-26(22(18-9-3-1-4-10-18)19-11-5-2-6-12-19)32-31-25-24(33(35)36)27(30-17-29-25)37-21-15-7-13-20-14-8-16-28-23(20)21/h1-17,22H,(H,32,34)(H,29,30,31)