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ethyl N-ethyl-2-[(4-methyl-2,6-dinitro-phenyl)amino]propanimidothioate

ethyl N-ethyl-2-[(4-methyl-2,6-dinitro-phenyl)amino]propanimidothioate

Systemtic Name:ethyl N-ethyl-2-[(4-methyl-2,6-dinitro-phenyl)amino]propanimidothioate
Openeye Name:ethyl N-ethyl-2-(4-methyl-2,6-dinitro-anilino)propanimidothioate
CAS Name:N-ethyl-2-(4-methyl-2,6-dinitroanilino)propanimidothioic acid ethyl ester
IUPAC Name:ethyl N-ethyl-2-(4-methyl-2,6-dinitroanilino)propanimidothioate
Traditional Name:N-ethyl-2-(4-methyl-2,6-dinitro-anilino)thiopropionimidic acid ethyl ester
Formula: C14H20N4O4S
MolecularWeight: 340.398
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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(C(C)NC1=C(C=C(C=C1[N+](=O)[O-])C)[N+](=O)[O-])SCC


Isomeric SMILES

CCN=C(C(C)NC1=C(C=C(C=C1[N+](=O)[O-])C)[N+](=O)[O-])SCC


InChI

InChI=1S/C14H20N4O4S/c1-5-15-14(23-6-2)10(4)16-13-11(17(19)20)7-9(3)8-12(13)18(21)22/h7-8,10,16H,5-6H2,1-4H3


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