4-bromanyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-bromo-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide CAS Name: 4-bromo-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-bromo-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Formula: C11H9BrN4O3S2 MolecularWeight: 389.24816

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C11H9BrN4O3S2/c1-2-20-11-15-14-10(21-11)13-9(17)6-3-4-7(12)8(5-6)16(18)19/h3-5H,2H2,1H3,(H,13,14,17)