AC1OBN4J

[4-[(E)-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]-2-methoxyphenyl] acetate

Also Known As: (E)-4-(((3-(4-ethoxyphenyl)-5-mercapto-4H-1,2,4-triazol-4-yl)imino)methyl)-2-methoxyphenyl acetate|[4-[(E)-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]-2-methoxyphenyl] acetate|4-[(E)-{[3-(4-ethoxyphenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]-2-methoxyphenyl acetate

Molecular Formula	C20H20N4O4S
Molecular Weight	412.1205 g/mol
LogP	3.82249
Topological Polar Surface Area	90.73 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	412.1205
Monoisotopic Mass	412.1205
Heavy Atoms	29
Complexity	1086.6058

Chemical Identifiers

CAS Number	613250-27-4
SMILES	CCOC1=CC=C(C=C1)C2=NNC(=S)N2/N=C/C3=CC(=C(C=C3)OC(=O)C)OC