2-[(4-methoxyphenyl)methylsulfanyl]-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole

Systemtic Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole Openeye Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-(5-nitro-2-furyl)-1,3,4-thiadiazole CAS Name: 2-[(4-methoxyphenyl)methylthio]-5-(5-nitro-2-furanyl)-1,3,4-thiadiazole IUPAC Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole Traditional Name: 2-(5-nitro-2-furyl)-5-(p-anisylthio)-1,3,4-thiadiazole Formula: C14H11N3O4S2 MolecularWeight: 349.38484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(S2)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(S2)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O4S2/c1-20-10-4-2-9(3-5-10)8-22-14-16-15-13(23-14)11-6-7-12(21-11)17(18)19/h2-7H,8H2,1H3