AC1LXUDA

(E)-N-[5-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide

Also Known As: N-(5-((4-methoxy-3-nitrobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide|(E)-N-[5-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide|(2E)-N-[(2E)-5-[(4-methoxy-3-nitrobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide|(2E)-N-{5-[(4-methoxy-3-nitrobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylprop-2-enamide|N-[5-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-prop-2-enamide

Molecular Formula	C19H16N4O4S2
Molecular Weight	428.0613 g/mol
LogP	4.3991
Topological Polar Surface Area	107.25 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	428.0613
Monoisotopic Mass	428.0613
Heavy Atoms	29
Complexity	1037.6982

Chemical Identifiers

CAS Number	690686-44-3
SMILES	COC1=C(C=C(C=C1)CSC2=NN=C(S2)NC(=O)/C=C/C3=CC=CC=C3)[N+](=O)[O-]