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

Systemtic Name: 4-ethoxy-3-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-ethoxy-3-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-ethoxy-3-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-ethoxy-3-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-4-ethoxy-3-nitro-benzamide Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O4S/c1-3-5-6-7-14-18-19-16(25-14)17-15(21)11-8-9-13(24-4-2)12(10-11)20(22)23/h8-10H,3-7H2,1-2H3,(H,17,19,21)