2-[1-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[1-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-[1-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-[1-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[1-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[1-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Formula: C19H23N5O3S MolecularWeight: 401.48262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SC(C)C2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SC(C)C2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C19H23N5O3S/c1-5-6-11-23-13(3)12(2)20-19(23)28-14(4)17-21-22-18(27-17)15-7-9-16(10-8-15)24(25)26/h7-10,14H,5-6,11H2,1-4H3