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

Systemtic Name: 5-(2-chloranyl-4-nitro-phenyl)-N-[3-(2-oxidanylidenepropyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide Openeye Name: N-(3-acetonyl-1,2,4-thiadiazol-5-yl)-5-(2-chloro-4-nitro-phenyl)furan-2-carboxamide CAS Name: 5-(2-chloro-4-nitrophenyl)-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-2-furancarboxamide IUPAC Name: 5-(2-chloro-4-nitrophenyl)-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide Traditional Name: N-(3-acetonyl-1,2,4-thiadiazol-5-yl)-5-(2-chloro-4-nitro-phenyl)-2-furamide Formula: C16H11ClN4O5S MolecularWeight: 406.80034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=NSC(=N1)NC(=O)C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)CC1=NSC(=N1)NC(=O)C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H11ClN4O5S/c1-8(22)6-14-18-16(27-20-14)19-15(23)13-5-4-12(26-13)10-3-2-9(21(24)25)7-11(10)17/h2-5,7H,6H2,1H3,(H,18,19,20,23)