[1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: [1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: [2-(tert-butylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-(3-methyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)propanoic acid [1-[[(tert-butylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 3-(3-methyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-3-methyl-quinazolin-2-yl)propionic acid [2-(tert-butylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)CCC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)CCC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C20H26N4O5/c1-12(17(26)22-19(28)23-20(2,3)4)29-16(25)11-10-15-21-14-9-7-6-8-13(14)18(27)24(15)5/h6-9,12H,10-11H2,1-5H3,(H2,22,23,26,28)