4-chloranyl-N'-[6-[2-(4-methylphenyl)sulfonylhydrazinyl]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: 4-chloranyl-N'-[6-[2-(4-methylphenyl)sulfonylhydrazinyl]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-3-nitro-N'-[5-nitro-6-[2-(p-tolylsulfonyl)hydrazino]pyrimidin-4-yl]benzohydrazide CAS Name: 4-chloro-N'-[6-[(4-methylphenyl)sulfonylhydrazo]-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[6-[2-(4-methylphenyl)sulfonylhydrazinyl]-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-3-nitro-N'-[5-nitro-6-(N'-tosylhydrazino)pyrimidin-4-yl]benzohydrazide Formula: C18H15ClN8O7S MolecularWeight: 522.8791

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN8O7S/c1-10-2-5-12(6-3-10)35(33,34)25-23-17-15(27(31)32)16(20-9-21-17)22-24-18(28)11-4-7-13(19)14(8-11)26(29)30/h2-9,25H,1H3,(H,24,28)(H2,20,21,22,23)