117063-98-6
1-(3-(4-MORPHOLINYL)-2-((1-PHENYL-1H-TETRAZOL-5-YL)THIO)PROPYL)-2-PYRROLIDINONE HYDROCHLORIDE
Name1-(3-(4-MORPHOLINYL)-2-((1-PHENYL-1H-TETRAZOL-5-YL)THIO)PROPYL)-2-PYRROLIDINONE HYDROCHLORIDE
FormulaC18 H24 N6 O2 S . Cl H
1Identification
【Name】
1-(3-(4-MORPHOLINYL)-2-((1-PHENYL-1H-TETRAZOL-5-YL)THIO)PROPYL)-2-PYRROLIDINONE HYDROCHLORIDE
【CAS】
【MDL】
MFCD01687212
【English Synonyms】
【Formula】
C18 H24 N6 O2 S . Cl H
【MolWeight】
424.954
【Inchi】
InChI=1S/C18H24N6O2S.ClH/c25-17-7-4-8-23(17)14-16(13-22-9-11-26-12-10-22)27-18-19-20-21-24(18)15-5-2-1-3-6-15;/h1-3,5-6,16H,4,7-14H2;1H
【InChIKey】
InChIKey=YRMAAROODAXJTO-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)n2c(nnn2)SC(CN3CCOCC3)CN4CCCC4=O.Cl
【MOL File】
1-(3-(4-MORPHOLINYL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(3-(4-MORPHOLINYL)-2-((1-PHENYL-1H-TETRAZOL-5-YL)THIO)PROPYL)-2-PYRROLIDINONE HYDROCHLORIDE.cml