186453-54-3
2-((2-HYDROXYPHENYL)METHYLENE)-N-((4-NITROPHENYL)METHYL)-HYDRAZINECARBOTHIOAMIDE
Name2-((2-HYDROXYPHENYL)METHYLENE)-N-((4-NITROPHENYL)METHYL)-HYDRAZINECARBOTHIOAMIDE
pro_formulaC15 H14 N4 O3 S
1Identification
【Name】
2-((2-HYDROXYPHENYL)METHYLENE)-N-((4-NITROPHENYL)METHYL)-HYDRAZINECARBOTHIOAMIDE
【CAS】
【MDL】
MFCD00607820
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H14 N4 O3 S
【pro_molWeight】
330.367
【Inchi】
InChI=1S/C15H14N4O3S/c20-14-4-2-1-3-12(14)10-17-18-15(23)16-9-11-5-7-13(8-6-11)19(21)22/h1-8,10,20H,9H2,(H2,16,18,23)/b17-10+
【InChIKey】
InChIKey=CMCJITFSQCIBHM-LICLKQGHSA-N
【SMILES】
c1ccc(c(c1)/C=N/NC(=S)NCc2ccc(cc2)[N+](=O)[O-])O
【MOL File】
2-((2-HYDROXYPHENYL)….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:3
pro_acceptors:7
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-((2-HYDROXYPHENYL)METHYLENE)-N-((4-NITROPHENYL)METHYL)-HYDRAZINECARBOTHIOAMIDE.cml