2-(4-chloranyl-3-nitro-phenyl)carbonyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 2-(4-chloranyl-3-nitro-phenyl)carbonyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 2-(4-chloro-3-nitro-benzoyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 2-(4-chloro-3-nitrobenzoyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 2-(4-chloro-3-nitro-benzoyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C18H13ClN4O4S MolecularWeight: 416.83822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClN4O4S/c1-2-15-21-22-18(28-15)20-17(25)12-6-4-3-5-11(12)16(24)10-7-8-13(19)14(9-10)23(26)27/h3-9H,2H2,1H3,(H,20,22,25)