577985-69-4
2-[[4-(2-FURANYLMETHYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]THIO]-N-(2-METHOXY-3-DIBENZOFURANYL)-ACETAMIDE
Name
2-[[4-(2-FURANYLMETHYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]THIO]-N-(2-METHOXY-3-DIBENZOFURANYL)-ACETAMIDE
pro_formula
C27 H21 N5 O4 S
pro_molWeight
511.56
1Identification
【Name】
2-[[4-(2-FURANYLMETHYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]THIO]-N-(2-METHOXY-3-DIBENZOFURANYL)-ACETAMIDE
【CAS】
【MDL】
MFCD04021818
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C27 H21 N5 O4 S
【pro_molWeight】
511.56
【Inchi】
InChI=1S/C27H21N5O4S/c1-34-24-12-20-19-8-2-3-9-22(19)36-23(20)13-21(24)29-25(33)16-37-27-31-30-26(17-6-4-10-28-14-17)32(27)15-18-7-5-11-35-18/h2-14H,15-16H2,1H3,(H,29,33)
【InChIKey】
InChIKey=CYGWARQAEKMLSJ-UHFFFAOYSA-N
【SMILES】
COc1cc2c3ccccc3oc2cc1NC(=O)CSc4nnc(n4Cc5ccco5)c6cccnc6
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:9
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-[[4-(2-FURANYLMETHYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]THIO]-N-(2-METHOXY-3-DIBENZOFURANYL)-ACETAMIDE.cml
quick_release
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