2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate

Systemtic Name: 2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate Openeye Name: 2-[2-(tert-butylamino)-2-oxo-ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[2-(tert-butylamino)-2-oxoethyl]thio]-4-quinazolinolate IUPAC Name: 2-[2-(tert-butylamino)-2-oxoethyl]sulfanylquinazolin-4-olate Traditional Name: 2-[[2-(tert-butylamino)-2-keto-ethyl]thio]quinazolin-4-olate Formula: C14H16N3O2S- MolecularWeight: 290.36074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)[O-]

InChI

InChI=1S/C14H17N3O2S/c1-14(2,3)17-11(18)8-20-13-15-10-7-5-4-6-9(10)12(19)16-13/h4-7H,8H2,1-3H3,(H,17,18)(H,15,16,19)/p-1