4,5-dimethoxy-2-nitro-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4,5-dimethoxy-2-nitro-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C14H16N4O5S2 MolecularWeight: 384.43064

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C14H16N4O5S2/c1-4-5-24-14-17-16-13(25-14)15-12(19)8-6-10(22-2)11(23-3)7-9(8)18(20)21/h6-7H,4-5H2,1-3H3,(H,15,16,19)