80085-38-7
1-METHYL-5-(3-(N-ETHYL-N-CYCLOHEXYLCARBONYLAMINO)PROPYL)THIO-1,2,3,4-T ETRAZOLE
Name1-METHYL-5-(3-(N-ETHYL-N-CYCLOHEXYLCARBONYLAMINO)PROPYL)THIO-1,2,3,4-T ETRAZOLE
pro_formulaC14 H25 N5 O S
1Identification
【Name】
1-METHYL-5-(3-(N-ETHYL-N-CYCLOHEXYLCARBONYLAMINO)PROPYL)THIO-1,2,3,4-T ETRAZOLE
【CAS】
【MDL】
MFCD01752174
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C14 H25 N5 O S
【pro_molWeight】
311.452
【Inchi】
InChI=1S/C14H25N5OS/c1-3-19(13(20)12-8-5-4-6-9-12)10-7-11-21-14-15-16-17-18(14)2/h12H,3-11H2,1-2H3
【InChIKey】
InChIKey=UFWASESOQFUAQE-UHFFFAOYSA-N
【SMILES】
CCN(CCCSc1nnnn1C)C(=O)C2CCCCC2
【MOL File】
1-METHYL-5-(3-(N-ETH….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:6
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-METHYL-5-(3-(N-ETHYL-N-CYCLOHEXYLCARBONYLAMINO)PROPYL)THIO-1,2,3,4-T ETRAZOLE.cml