methyl 9-(2,2-dimethylpropanoylamino)-4-oxidanylidene-pyrimido[1,2-c]quinazoline-3-carboxylate

Systemtic Name: methyl 9-(2,2-dimethylpropanoylamino)-4-oxidanylidene-pyrimido[1,2-c]quinazoline-3-carboxylate Openeye Name: methyl 9-(2,2-dimethylpropanoylamino)-4-oxo-pyrimido[1,2-c]quinazoline-3-carboxylate CAS Name: 9-[(2,2-dimethyl-1-oxopropyl)amino]-4-oxo-3-pyrimido[1,2-c]quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 9-(2,2-dimethylpropanoylamino)-4-oxopyrimido[1,2-c]quinazoline-3-carboxylate Traditional Name: 4-keto-9-(pivaloylamino)pyrimido[1,2-c]quinazoline-3-carboxylic acid methyl ester Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC2=C(C=C1)C3=NC=C(C(=O)N3C=N2)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC2=C(C=C1)C3=NC=C(C(=O)N3C=N2)C(=O)OC

InChI

InChI=1S/C18H18N4O4/c1-18(2,3)17(25)21-10-5-6-11-13(7-10)20-9-22-14(11)19-8-12(15(22)23)16(24)26-4/h5-9H,1-4H3,(H,21,25)