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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

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