2-[(4-methoxyphenyl)methyl]-5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3,4-oxadiazole

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-[(4-methoxyphenyl)methyl]-5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-[(4-methoxyphenyl)methyl]-5-[(2-methyl-3-nitrophenyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-[(4-methoxyphenyl)methyl]-5-[(2-methyl-3-nitrophenyl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-[(2-methyl-3-nitro-benzyl)thio]-5-p-anisyl-1,3,4-oxadiazole Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NN=C(O2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NN=C(O2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H17N3O4S/c1-12-14(4-3-5-16(12)21(22)23)11-26-18-20-19-17(25-18)10-13-6-8-15(24-2)9-7-13/h3-9H,10-11H2,1-2H3