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

Systemtic Name: 4-methyl-3,5-dinitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-methyl-3,5-dinitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-methyl-3,5-dinitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-methyl-3,5-dinitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-methyl-3,5-dinitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C13H13N5O5S MolecularWeight: 351.33782

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O5S/c1-3-4-11-15-16-13(24-11)14-12(19)8-5-9(17(20)21)7(2)10(6-8)18(22)23/h5-6H,3-4H2,1-2H3,(H,14,16,19)