N-ethyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-ethyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-ethyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-ethyl-5-[1-(3-nitrophenyl)ethylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-ethyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: ethyl-[5-[1-(3-nitrophenyl)ethylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C12H14N4O2S2 MolecularWeight: 310.39516

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SC(C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCNC1=NN=C(S1)SC(C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O2S2/c1-3-13-11-14-15-12(20-11)19-8(2)9-5-4-6-10(7-9)16(17)18/h4-8H,3H2,1-2H3,(H,13,14)