186453-55-4
HYDRAZINECARBOTHIOAMIDE, N-((3-BROMO-4-METHOXYPHENYL)METHYL)-2-((2-HYD ROXYPHENYL)METHYLENE)-
NameHYDRAZINECARBOTHIOAMIDE, N-((3-BROMO-4-METHOXYPHENYL)METHYL)-2-((2-HYD ROXYPHENYL)METHYLENE)-
FormulaC16 H16 Br N3 O2 S
1Identification
【Name】
HYDRAZINECARBOTHIOAMIDE, N-((3-BROMO-4-METHOXYPHENYL)METHYL)-2-((2-HYD ROXYPHENYL)METHYLENE)-
【CAS】
【MDL】
MFCD00607811
【English Synonyms】
【Formula】
C16 H16 Br N3 O2 S
【MolWeight】
394.291
【Inchi】
InChI=1S/C16H16BrN3O2S/c1-22-15-7-6-11(8-13(15)17)9-18-16(23)20-19-10-12-4-2-3-5-14(12)21/h2-8,10,21H,9H2,1H3,(H2,18,20,23)/b19-10+
【InChIKey】
InChIKey=WZECTZMISWXXQA-VXLYETTFSA-N
【SMILES】
COc1ccc(cc1Br)CNC(=S)N/N=C/c2ccccc2O
【MOL File】
HYDRAZINECARBOTHIOAM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
HYDRAZINECARBOTHIOAMIDE, N-((3-BROMO-4-METHOXYPHENYL)METHYL)-2-((2-HYD ROXYPHENYL)METHYLENE)-.cml