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

Systemtic Name: 3-chloranyl-4-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-chloro-4-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-chloro-4-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3-chloro-4-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 3-chloro-4-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C12H11ClN4O3S MolecularWeight: 326.75874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClN4O3S/c1-2-3-10-15-16-12(21-10)14-11(18)7-4-5-9(17(19)20)8(13)6-7/h4-6H,2-3H2,1H3,(H,14,16,18)