4-[5-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-[2-(4-tert-butylphenyl)-2-oxo-ethyl]sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-[[2-(4-tert-butylphenyl)-2-oxoethyl]thio]-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-[2-(4-tert-butylphenyl)-2-oxoethyl]sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-[[2-(4-tert-butylphenyl)-2-keto-ethyl]thio]-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NNC(=C3C=CC(=O)C=C3)O2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NNC(=C3C=CC(=O)C=C3)O2

InChI

InChI=1S/C20H20N2O3S/c1-20(2,3)15-8-4-13(5-9-15)17(24)12-26-19-22-21-18(25-19)14-6-10-16(23)11-7-14/h4-11,21H,12H2,1-3H3