AC1NX6OY

5-(2-hydroxyphenyl)-3-[(3-nitroanilino)methyl]-1,3,4-oxadiazole-2-thione

Also Known As: AG-205/33681038|1,3,4-Oxadiazole-2(3H)-thione, 5-(2-hydroxyphenyl)-3-(((3-nitrophenyl)amino)methyl)-|5-(2-Hydroxyphenyl)-3-(((3-nitrophenyl)amino)methyl)-1,3,4-oxadiazole-2(3H)-thione|3-({3-nitroanilino}methyl)-5-(2-hydroxyphenyl)-1,3,4-oxadiazole-2(3H)-thione|5-(2-Hydroxyphenyl)-3-[(3-nitrophenyl)aminomethyl]-1,3,4-oxadiazole-2(3H)-thione|(6E)-6-[4-[(3-nitroanilino)methyl]-5-sulfanylidene-1,3,4-oxadiazolidin-2-ylidene]cyclohexa-2,4-dien-1-one|(6Z)-6-[4-[(3-nitroanilino)methyl]-5-sulfanylidene-1,3,4-oxadiazolidin-2-ylidene]cyclohexa-2,4-dien-1-one|5-(2-hydroxyphenyl)-3-{[(3-nitrophenyl)amino]methyl}-2,3-dihydro-1,3,4-oxadiazole-2-thione|6-[4-[(3-nitroanilino)methyl]-5-sulfanylidene-1,3,4-oxadiazolidin-2-ylidene]cyclohexa-2,4-dien-1-one

Molecular Formula	C15H12N4O4S
Molecular Weight	344.05792 g/mol
LogP	3.55599
Topological Polar Surface Area	106.36 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	344.05792
Monoisotopic Mass	344.05792
Heavy Atoms	24
Complexity	950.39716

Chemical Identifiers

CAS Number	54543-83-8
SMILES	C1=CC=C(C(=C1)C2=NN(C(=S)O2)CNC3=CC(=CC=C3)[N+](=O)[O-])O