2-(4-nitrophenyl)-5-[(2-thiophen-2-ylquinazolin-4-yl)sulfanylmethyl]-1,3,4-oxadiazole

Systemtic Name: 2-(4-nitrophenyl)-5-[(2-thiophen-2-ylquinazolin-4-yl)sulfanylmethyl]-1,3,4-oxadiazole Openeye Name: 2-(4-nitrophenyl)-5-[[2-(2-thienyl)quinazolin-4-yl]sulfanylmethyl]-1,3,4-oxadiazole CAS Name: 2-(4-nitrophenyl)-5-[[(2-thiophen-2-yl-4-quinazolinyl)thio]methyl]-1,3,4-oxadiazole IUPAC Name: 2-(4-nitrophenyl)-5-[(2-thiophen-2-ylquinazolin-4-yl)sulfanylmethyl]-1,3,4-oxadiazole Traditional Name: 2-(4-nitrophenyl)-5-[[[2-(2-thienyl)quinazolin-4-yl]thio]methyl]-1,3,4-oxadiazole Formula: C21H13N5O3S2 MolecularWeight: 447.48962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CS3)SCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CS3)SCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H13N5O3S2/c27-26(28)14-9-7-13(8-10-14)20-25-24-18(29-20)12-31-21-15-4-1-2-5-16(15)22-19(23-21)17-6-3-11-30-17/h1-11H,12H2