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

Systemtic Name: 2-chloranyl-5-nitro-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 2-chloro-5-nitro-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 2-chloro-5-nitro-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 2-chloro-5-nitro-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 2-chloro-5-nitro-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C17H13ClN4O3S MolecularWeight: 388.82812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NN=C(S2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NN=C(S2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H13ClN4O3S/c18-14-8-7-12(22(24)25)10-13(14)16(23)19-17-21-20-15(26-17)9-6-11-4-2-1-3-5-11/h1-5,7-8,10H,6,9H2,(H,19,21,23)