82394-10-3
4-METHOXY-11-(METHYLAMINOMETHYL)-6,11-DIHYDRODIBENZO(B,E)THIEPIN HYDRO CHLORIDE
Name4-METHOXY-11-(METHYLAMINOMETHYL)-6,11-DIHYDRODIBENZO(B,E)THIEPIN HYDRO CHLORIDE
pro_formulaC17 H19 N O S . Cl H
1Identification
【Name】
4-METHOXY-11-(METHYLAMINOMETHYL)-6,11-DIHYDRODIBENZO(B,E)THIEPIN HYDRO CHLORIDE
【CAS】
【MDL】
MFCD01730759
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C17 H19 N O S . Cl H
【pro_molWeight】
321.87
【Inchi】
InChI=1S/C17H19NOS.ClH/c1-18-10-15-13-7-4-3-6-12(13)11-20-17-14(15)8-5-9-16(17)19-2;/h3-9,15,18H,10-11H2,1-2H3;1H
【InChIKey】
InChIKey=NMQXJIAJDPUOSU-UHFFFAOYSA-N
【SMILES】
CNCC1c2ccccc2CSc3c1cccc3OC.Cl
【MOL File】
4-METHOXY-11-(METHYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:2
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-METHOXY-11-(METHYLAMINOMETHYL)-6,11-DIHYDRODIBENZO(B,E)THIEPIN HYDRO CHLORIDE.cml