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

Systemtic Name: 2-methoxy-N'-[6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2-methoxy-N'-[5-nitro-6-(p-tolylsulfanyl)pyrimidin-4-yl]benzohydrazide CAS Name: 2-methoxy-N'-[6-[(4-methylphenyl)thio]-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-methoxy-N'-[6-(4-methylphenyl)sulfanyl-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2-methoxy-N'-[5-nitro-6-(p-tolylthio)pyrimidin-4-yl]benzohydrazide Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C19H17N5O4S/c1-12-7-9-13(10-8-12)29-19-16(24(26)27)17(20-11-21-19)22-23-18(25)14-5-3-4-6-15(14)28-2/h3-11H,1-2H3,(H,23,25)(H,20,21,22)