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

Systemtic Name: 3-chloranyl-4-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-chloro-4-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-chloro-4-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3-chloro-4-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-3-chloro-4-nitro-benzamide Formula: C14H15ClN4O3S MolecularWeight: 354.8119

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClN4O3S/c1-2-3-4-5-12-17-18-14(23-12)16-13(20)9-6-7-11(19(21)22)10(15)8-9/h6-8H,2-5H2,1H3,(H,16,18,20)