3-methyl-2-nitro-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 3-methyl-2-nitro-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-methyl-2-nitro-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-methyl-2-nitro-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3-methyl-2-nitro-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 3-methyl-2-nitro-N-(5-octyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O3S/c1-3-4-5-6-7-8-12-15-20-21-18(26-15)19-17(23)14-11-9-10-13(2)16(14)22(24)25/h9-11H,3-8,12H2,1-2H3,(H,19,21,23)