1-[5-(4-methylphenyl)-2-(5-nitrothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone

Systemtic Name: 1-[5-(4-methylphenyl)-2-(5-nitrothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone Openeye Name: 1-[2-(5-nitro-2-thienyl)-5-(p-tolyl)-2H-1,3,4-oxadiazol-3-yl]ethanone CAS Name: 1-[5-(4-methylphenyl)-2-(5-nitro-2-thiophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone IUPAC Name: 1-[5-(4-methylphenyl)-2-(5-nitrothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone Traditional Name: 1-[2-(5-nitro-2-thienyl)-5-(p-tolyl)-2H-1,3,4-oxadiazol-3-yl]ethanone Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(O2)C3=CC=C(S3)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(O2)C3=CC=C(S3)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C15H13N3O4S/c1-9-3-5-11(6-4-9)14-16-17(10(2)19)15(22-14)12-7-8-13(23-12)18(20)21/h3-8,15H,1-2H3