2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-N'-pyrimidin-2-yl-benzohydrazide

Systemtic Name: 2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-N'-pyrimidin-2-yl-benzohydrazide Openeye Name: 2-(4-methylsulfanyl-3-nitro-benzoyl)-N'-pyrimidin-2-yl-benzohydrazide CAS Name: 2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]-N'-(2-pyrimidinyl)benzohydrazide IUPAC Name: 2-(4-methylsulfanyl-3-nitrobenzoyl)-N'-pyrimidin-2-ylbenzohydrazide Traditional Name: 2-[4-(methylthio)-3-nitro-benzoyl]-N'-(2-pyrimidyl)benzohydrazide Formula: C19H15N5O4S MolecularWeight: 409.4185

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NNC3=NC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NNC3=NC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H15N5O4S/c1-29-16-8-7-12(11-15(16)24(27)28)17(25)13-5-2-3-6-14(13)18(26)22-23-19-20-9-4-10-21-19/h2-11H,1H3,(H,22,26)(H,20,21,23)