2-[[[6-(2,2-dimethylpropanoylamino)quinazolin-4-yl]amino]methylidene]propanedioic acid

Systemtic Name: 2-[[[6-(2,2-dimethylpropanoylamino)quinazolin-4-yl]amino]methylidene]propanedioic acid Openeye Name: 2-[[[6-(2,2-dimethylpropanoylamino)quinazolin-4-yl]amino]methylene]propanedioic acid CAS Name: 2-[[[6-[(2,2-dimethyl-1-oxopropyl)amino]-4-quinazolinyl]amino]methylidene]propanedioic acid IUPAC Name: 2-[[[6-(2,2-dimethylpropanoylamino)quinazolin-4-yl]amino]methylidene]propanedioic acid Traditional Name: 2-[[[6-(pivaloylamino)quinazolin-4-yl]amino]methylene]malonic acid Formula: C17H18N4O5 MolecularWeight: 358.34862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC2=C(C=C1)N=CN=C2NC=C(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC2=C(C=C1)N=CN=C2NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C17H18N4O5/c1-17(2,3)16(26)21-9-4-5-12-10(6-9)13(20-8-19-12)18-7-11(14(22)23)15(24)25/h4-8H,1-3H3,(H,21,26)(H,22,23)(H,24,25)(H,18,19,20)