N'-[6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-2-phenyl-ethanehydrazide

Systemtic Name: N'-[6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-2-phenyl-ethanehydrazide Openeye Name: N'-[5-nitro-6-(p-tolylsulfanyl)pyrimidin-4-yl]-2-phenyl-acetohydrazide CAS Name: N'-[6-[(4-methylphenyl)thio]-5-nitro-4-pyrimidinyl]-2-phenylacetohydrazide IUPAC Name: N'-[6-(4-methylphenyl)sulfanyl-5-nitropyrimidin-4-yl]-2-phenylacetohydrazide Traditional Name: N'-[5-nitro-6-(p-tolylthio)pyrimidin-4-yl]-2-phenyl-acetohydrazide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H17N5O3S/c1-13-7-9-15(10-8-13)28-19-17(24(26)27)18(20-12-21-19)23-22-16(25)11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,22,25)(H,20,21,23)