3,5-dinitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 3,5-dinitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3,5-dinitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3,5-dinitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3,5-dinitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-3,5-dinitro-benzamide Formula: C14H15N5O5S MolecularWeight: 365.3644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O5S/c1-2-3-4-5-12-16-17-14(25-12)15-13(20)9-6-10(18(21)22)8-11(7-9)19(23)24/h6-8H,2-5H2,1H3,(H,15,17,20)