AC1NA0WF structure

AC1NA0WF

7-propan-2-ylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene-5-thione

Also Known As: 5-(isopropylthio)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol|5-(propan-2-ylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3(2H)-thione

CAS: 862191-98-8
Molecular Formula C14H16N4S3
Molecular Weight 336.0537 g/mol
LogP 4.38089
Topological Polar Surface Area 45.98 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 2
Exact Mass 336.0537
Monoisotopic Mass 336.0537
Heavy Atoms 21
Complexity 887.0151

Chemical Identifiers

CAS Number 862191-98-8
SMILES CC(C)SC1=NC2=C(C3=C(S2)CCCC3)C4=NNC(=S)N41

Product Overview

AC1NA0WF (CAS 862191-98-8), with molecular formula C14H16N4S3 and molecular weight 336.0537 g/mol. IUPAC: 7-propan-2-ylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene-5-thione.

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