2-[4-oxidanylidene-3-[(2S)-pentan-2-yl]quinazolin-2-yl]sulfanylethanoate

Systemtic Name: 2-[4-oxidanylidene-3-[(2S)-pentan-2-yl]quinazolin-2-yl]sulfanylethanoate Openeye Name: 2-[3-[(1S)-1-methylbutyl]-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[4-oxo-3-[(2S)-pentan-2-yl]-2-quinazolinyl]thio]acetate IUPAC Name: 2-[4-oxo-3-[(2S)-pentan-2-yl]quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-keto-3-[(1S)-1-methylbutyl]quinazolin-2-yl]thio]acetate Formula: C15H17N2O3S- MolecularWeight: 305.37208

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)[O-]

Isomeric SMILES

CCC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)[O-]

InChI

InChI=1S/C15H18N2O3S/c1-3-6-10(2)17-14(20)11-7-4-5-8-12(11)16-15(17)21-9-13(18)19/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,18,19)/p-1/t10-/m0/s1