5-(2-chloranyl-4-nitro-phenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide

Systemtic Name: 5-(2-chloranyl-4-nitro-phenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide Openeye Name: 5-(2-chloro-4-nitro-phenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide CAS Name: 5-(2-chloro-4-nitrophenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-furancarboxamide IUPAC Name: 5-(2-chloro-4-nitrophenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide Traditional Name: 5-(2-chloro-4-nitro-phenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-furamide Formula: C16H13ClN4O4S MolecularWeight: 392.81682

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H13ClN4O4S/c1-2-3-14-19-20-16(26-14)18-15(22)13-7-6-12(25-13)10-5-4-9(21(23)24)8-11(10)17/h4-8H,2-3H2,1H3,(H,18,20,22)