N-tert-butyl-1-[3-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2,4-thiadiazol-5-yl]methanimine oxide

Systemtic Name: N-tert-butyl-1-[3-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2,4-thiadiazol-5-yl]methanimine oxide Openeye Name: N-tert-butyl-1-[3-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1,2,4-thiadiazol-5-yl]methanimine oxide CAS Name: N-tert-butyl-1-[3-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-1,2,4-thiadiazol-5-yl]methanimine oxide IUPAC Name: N-tert-butyl-1-[3-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-thiadiazol-5-yl]methanimine oxide Traditional Name: N-tert-butyl-1-[3-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-1,2,4-thiadiazol-5-yl]methanimine oxide Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2NSC(=N2)C=[N+](C(C)(C)C)[O-])C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2NSC(=N2)/C=[N+](/C(C)(C)C)\[O-])C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C21H31N3O2S/c1-19(2,3)14-10-13(11-15(17(14)25)20(4,5)6)18-22-16(27-23-18)12-24(26)21(7,8)9/h10-12,23H,1-9H3/b24-12-