5-nitro-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]furan-2-carboxamide

Systemtic Name: 5-nitro-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]furan-2-carboxamide Openeye Name: N-[5-(3-isopropylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-5-nitro-furan-2-carboxamide CAS Name: 5-nitro-N-[5-[3-(propan-2-ylthio)phenyl]-1,3,4-oxadiazol-2-yl]-2-furancarboxamide IUPAC Name: 5-nitro-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]furan-2-carboxamide Traditional Name: N-[5-[3-(isopropylthio)phenyl]-1,3,4-oxadiazol-2-yl]-5-nitro-2-furamide Formula: C16H14N4O5S MolecularWeight: 374.37116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC(=C1)C2=NN=C(O2)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC(C)SC1=CC=CC(=C1)C2=NN=C(O2)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O5S/c1-9(2)26-11-5-3-4-10(8-11)15-18-19-16(25-15)17-14(21)12-6-7-13(24-12)20(22)23/h3-9H,1-2H3,(H,17,19,21)