N'-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide

Systemtic Name: N'-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide Openeye Name: N'-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide CAS Name: N'-[6-[(4-chlorophenyl)thio]-5-nitro-4-pyrimidinyl]-4-methylbenzenesulfonohydrazide IUPAC Name: N'-[6-(4-chlorophenyl)sulfanyl-5-nitropyrimidin-4-yl]-4-methylbenzenesulfonohydrazide Traditional Name: N'-[6-[(4-chlorophenyl)thio]-5-nitro-pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide Formula: C17H14ClN5O4S2 MolecularWeight: 451.90716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN5O4S2/c1-11-2-8-14(9-3-11)29(26,27)22-21-16-15(23(24)25)17(20-10-19-16)28-13-6-4-12(18)5-7-13/h2-10,22H,1H3,(H,19,20,21)