N-(2-methoxyethyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(2-methoxyethyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(2-methoxyethyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(2-methoxyethyl)-5-[(4-nitrophenyl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2-methoxyethyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: 2-methoxyethyl-[5-[(4-nitrobenzyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C12H14N4O3S2 MolecularWeight: 326.39456

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NN=C(S1)SCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=NN=C(S1)SCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3S2/c1-19-7-6-13-11-14-15-12(21-11)20-8-9-2-4-10(5-3-9)16(17)18/h2-5H,6-8H2,1H3,(H,13,14)