AC1NC2AU

14-ethyl-5-heptylsulfanyl-14-methyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

Also Known As: 10-ethyl-3-(heptylsulfanyl)-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine|10-ethyl-3-(heptylthio)-10-methyl-5-(methylthio)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine

Molecular Formula	C21H30N4OS3
Molecular Weight	450.15817 g/mol
LogP	6.3648
Topological Polar Surface Area	52.31 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	450.15817
Monoisotopic Mass	450.15817
Heavy Atoms	29
Complexity	999.0426

Chemical Identifiers

CAS Number	371925-60-9
SMILES	CCCCCCCSC1=NN=C2N1C(=NC3=C2C4=C(S3)COC(C4)(C)CC)SC