[1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidenequinazolin-3-yl)propanoate

Systemtic Name: [1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: [2-(cyclohexylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(4-oxo-3-quinazolinyl)propanoic acid [1-[[(cyclohexylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl] 3-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-ketoquinazolin-3-yl)propionic acid [2-(cyclohexylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H26N4O5 MolecularWeight: 414.45494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)OC(=O)CCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C(=O)NC(=O)NC1CCCCC1)OC(=O)CCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H26N4O5/c1-14(19(27)24-21(29)23-15-7-3-2-4-8-15)30-18(26)11-12-25-13-22-17-10-6-5-9-16(17)20(25)28/h5-6,9-10,13-15H,2-4,7-8,11-12H2,1H3,(H2,23,24,27,29)