3-(4-tert-butylphenyl)-5-[(E)-2-(5-nitrothiophen-3-yl)ethenyl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-tert-butylphenyl)-5-[(E)-2-(5-nitrothiophen-3-yl)ethenyl]-1,2,4-oxadiazole Openeye Name: 3-(4-tert-butylphenyl)-5-[(E)-2-(5-nitro-3-thienyl)vinyl]-1,2,4-oxadiazole CAS Name: 3-(4-tert-butylphenyl)-5-[(E)-2-(5-nitro-3-thiophenyl)ethenyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-tert-butylphenyl)-5-[(E)-2-(5-nitrothiophen-3-yl)ethenyl]-1,2,4-oxadiazole Traditional Name: 3-(4-tert-butylphenyl)-5-[(E)-2-(5-nitro-3-thienyl)vinyl]-1,2,4-oxadiazole Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NOC(=N2)C=CC3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NOC(=N2)/C=C/C3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S/c1-18(2,3)14-7-5-13(6-8-14)17-19-15(24-20-17)9-4-12-10-16(21(22)23)25-11-12/h4-11H,1-3H3/b9-4+