[3-(2,2-dimethylpropanoylamino)-4-oxidanylidene-quinazolin-2-yl]methanesulfonic acid

Systemtic Name: [3-(2,2-dimethylpropanoylamino)-4-oxidanylidene-quinazolin-2-yl]methanesulfonic acid Openeye Name: [3-(2,2-dimethylpropanoylamino)-4-oxo-quinazolin-2-yl]methanesulfonic acid CAS Name: [3-[(2,2-dimethyl-1-oxopropyl)amino]-4-oxo-2-quinazolinyl]methanesulfonic acid IUPAC Name: [3-(2,2-dimethylpropanoylamino)-4-oxoquinazolin-2-yl]methanesulfonic acid Traditional Name: [4-keto-3-(pivaloylamino)quinazolin-2-yl]methanesulfonic acid Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NN1C(=NC2=CC=CC=C2C1=O)CS(=O)(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NN1C(=NC2=CC=CC=C2C1=O)CS(=O)(=O)O

InChI

InChI=1S/C14H17N3O5S/c1-14(2,3)13(19)16-17-11(8-23(20,21)22)15-10-7-5-4-6-9(10)12(17)18/h4-7H,8H2,1-3H3,(H,16,19)(H,20,21,22)